data_1n02_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 1n02 _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 4' ' ' PHE . . . . . . . . . . . . . 33.5 p90 . . . . . 0 N--CA 1.462 0.159 0 CA-C-O 120.912 0.387 . . . . 0.31 110.661 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.511 ' HB ' ' HB3' ' A' ' 67' ' ' SER . 2.2 tp -63.03 -19.42 23.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 1.0600000000000001 111.569 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -75.65 -27.25 58.3 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.904 -0.318 . . . . 2.0099999999999998 111.151 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 50.6 p -118.78 14.11 13.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.519 -0.31 . . . . 1.0700000000000001 111.501 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.2 m -129.67 151.32 50.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.067 0.461 . . . . 0.28999999999999998 111.353 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.62 172.83 12.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.715 -0.675 . . . . 3.0099999999999998 110.723 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.44 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 4.9 p-10 49.16 56.05 8.38 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.211 -0.45 . . . . 1.74 111.875 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.1 p -79.19 134.1 36.69 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.733 -0.469 . . . . 1.02 109.733 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -157.26 163.41 38.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.125 -0.489 . . . . 1.9399999999999999 111.511 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.535 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.5 OUTLIER -97.35 136.56 37.65 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.713 -0.676 . . . . 1.02 110.958 -179.664 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.565 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.1 146.29 46.08 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.319 -0.855 . . . . 1.03 109.324 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.21 -152.64 24.5 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.002 -1.094 . . . . 0.12 111.438 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.52 -36.41 18.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.014 0.407 . . . . 0.83999999999999997 111.352 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.523 ' OG ' ' HB3' ' A' ' 38' ' ' ASP . 8.0 p -144.71 72.17 1.33 Allowed 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.509 -0.923 . . . . 0.75 108.509 179.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.565 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 4.5 mp0 -146.13 141.19 27.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.538 -0.756 . . . . 1.1299999999999999 111.508 176.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.468 ' CB ' HD11 ' A' ' 37' ' ' LEU . 21.2 tp -121.45 120.98 36.52 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.102 -0.703 . . . . 1.02 109.102 177.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.42 144.33 45.1 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.712 -0.477 . . . . 1.02 109.712 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.56 172.51 16.24 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.061 -0.518 . . . . 0.98999999999999999 110.729 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -112.83 133.25 54.91 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.163 -1.051 . . . . 1.5800000000000001 108.163 176.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 59.0 m -131.0 136.39 48.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.228 0.537 . . . . 0.17999999999999999 112.025 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 5.4 ptpt -68.03 135.22 51.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.465 -0.789 . . . . 1.3999999999999999 111.632 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.7 p -87.03 -175.43 5.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.246 -0.888 . . . . 1.04 110.617 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -59.16 -33.73 71.26 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.604 0.594 . . . . 3.5 112.604 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.45 11.67 8.2 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.554 0.576 . . . . 0.93999999999999995 112.554 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 67.09 41.86 2.51 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.589 0.709 . . . . 1.9099999999999999 110.497 -178.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.464 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 11.5 mt-30 -116.68 132.63 56.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.692 -1.14 . . . . 2.0800000000000001 108.513 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -90.66 124.21 34.89 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.495 -0.482 . . . . 1.5700000000000001 110.727 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.7 m -122.29 160.89 23.89 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-O 120.974 0.416 . . . . 1.04 111.584 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.46 126.5 31.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.844 -0.616 . . . . 1.6699999999999999 111.151 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.5 t -140.42 157.46 45.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.327 -0.397 . . . . 1.01 110.779 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -145.9 142.35 28.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.236 0.541 . . . . 2.1099999999999999 112.106 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.43 ' CG2' ' HB3' ' A' ' 19' ' ' LEU . 1.9 tp -118.57 126.62 75.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.367 -0.833 . . . . 1.03 108.77 178.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -87.3 118.64 26.87 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 122.271 -0.268 . . . . 1.5900000000000001 110.672 -178.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.468 HD11 ' CB ' ' A' ' 19' ' ' LEU . 4.7 mp -87.56 -16.05 35.71 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.353 0.501 . . . . 1.03 112.353 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.533 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 23.3 p30 -56.07 -45.38 79.33 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.582 0.586 . . . . 1.8899999999999999 112.582 -177.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.533 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 2.5 p30 -91.37 -10.25 41.87 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 122.261 -0.274 . . . . 1.6599999999999999 111.699 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -97.32 -64.21 1.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.747 -0.464 . . . . 0.28999999999999998 109.747 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.428 HD13 ' CD1' ' A' ' 50' ' ' TRP . 25.6 mm -81.01 151.27 4.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.85 -0.614 . . . . 1.6499999999999999 111.358 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.478 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.15 172.18 13.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.495 -0.775 . . . . 0.98999999999999999 111.327 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.67 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 23.1 t30 -111.34 110.91 21.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.943 -0.571 . . . . 0.17999999999999999 110.614 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.6 mm -110.39 92.34 2.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.947 -0.569 . . . . 1.74 112.004 -179.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 20.4 t0 62.65 37.18 13.06 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.777 0.323 . . . . 1.1299999999999999 111.252 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.26 0.79 88.5 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.612 -0.804 . . . . 0.14000000000000001 112.942 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.5 m -113.18 135.5 53.75 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.982 0.391 . . . . 1.0600000000000001 110.649 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.2 mt -77.04 118.72 19.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.604 0.716 . . . . 1.0900000000000001 110.95 -178.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -137.15 162.51 33.23 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 114.654 -1.157 . . . . 1.9199999999999999 110.042 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.476 ' CE2' HG12 ' A' ' 90' ' ' VAL . 9.7 m-90 -85.54 119.15 25.57 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.999 0.428 . . . . 0.28999999999999998 111.466 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -174.9 141.22 0.69 Allowed Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.829 -0.623 . . . . 1.95 110.131 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -66.07 70.18 0.4 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.195 1.93 . . . . 0.70999999999999996 112.979 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.478 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.0 p -155.08 137.32 14.83 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.831 -1.077 . . . . 0.68000000000000005 108.154 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.406 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.5 OUTLIER -80.95 104.2 11.3 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.097 0.777 . . . . 1.02 113.097 -176.806 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.498 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 44.2 p90 -51.9 -36.59 49.35 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.195 -0.911 . . . . 0.89000000000000001 110.108 177.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 77.5 p -45.82 -25.1 0.46 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 114.938 -1.028 . . . . 0.79000000000000004 112.939 -178.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -66.27 -20.24 66.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.676 0.275 . . . . 1.99 111.352 -179.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.67 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 30.1 p -128.69 6.71 5.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.485 -0.325 . . . . 1.05 111.007 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.2 m -126.45 149.67 49.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.209 0.528 . . . . 0.11 111.703 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.3 p90 -142.42 157.86 44.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.319 -0.855 . . . . 1.6599999999999999 109.817 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 54.1 m-20 63.38 46.65 4.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.096 0.474 . . . . 1.55 110.639 -179.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 46.1 m -69.37 135.11 49.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.847 -0.615 . . . . 0.76000000000000001 110.178 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.437 ' O ' HD11 ' A' ' 69' ' ' LEU . . . -141.96 150.04 40.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.493 . . . . 1.04 111.703 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.535 HG13 ' HB2' ' A' ' 13' ' ' LEU . 38.6 mt -130.45 142.44 43.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.222 0.534 . . . . 1.04 111.86 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -139.64 111.93 7.64 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.253 -0.885 . . . . 2.1800000000000002 108.847 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.75 -122.97 21.32 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.242 -0.98 . . . . 0.13 111.58 -178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.511 ' HB3' ' HB ' ' A' ' 5' ' ' ILE . 82.5 p -100.36 -5.64 26.99 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.492 0.553 . . . . 0.73999999999999999 112.492 -178.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.6 t -102.8 139.87 22.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 121.052 0.453 . . . . 1.04 111.692 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.437 HD11 ' O ' ' A' ' 63' ' ' ALA . 7.1 tp -102.25 126.95 49.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.824 -0.625 . . . . 0.98999999999999999 110.89 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.428 ' N ' HD11 ' A' ' 69' ' ' LEU . 4.5 m -116.04 123.99 49.32 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.962 -0.385 . . . . 1.05 109.962 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 82' ' ' THR . 11.2 t -151.54 153.38 34.43 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.253 -0.179 . . . . 0.81999999999999995 111.245 -178.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.557 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 15.6 m -95.72 126.47 41.01 Favored 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 109.832 -0.433 . . . . 1.04 109.832 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.424 ' HB3' ' OD1' ' A' ' 43' ' ' ASN . 72.3 m -126.87 145.85 50.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.361 0.6 . . . . 0.10000000000000001 112.17 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -74.96 139.08 42.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.167 -0.924 . . . . 1.26 111.113 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -91.32 145.0 25.01 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.915 -0.402 . . . . 3.9100000000000001 109.915 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 34.9 m -51.46 -32.1 25.74 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.466 0.543 . . . . 1.0700000000000001 112.466 -178.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -83.58 4.6 27.52 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.04 0.385 . . . . 1.97 112.04 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.15 136.94 8.02 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.668 -0.777 . . . . 0.16 113.106 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 119.55 -174.58 15.52 Favored Glycine 0 N--CA 1.451 -0.337 0 N-CA-C 110.94 -0.864 . . . . 0.17999999999999999 110.94 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -130.63 140.88 50.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.383 0.592 . . . . 1.26 111.032 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -154.16 131.04 10.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.139 -0.482 . . . . 1.8799999999999999 110.421 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.557 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.3 t -93.71 134.67 35.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.98999999999999999 111.118 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.1 p -120.19 158.03 27.83 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.191 -0.459 . . . . 0.77000000000000002 110.446 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.49 144.48 49.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.977 0.418 . . . . 1.55 111.045 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.446 HD11 ' CZ2' ' A' ' 50' ' ' TRP . 11.0 tt -145.79 143.16 21.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.939 -0.573 . . . . 1.45 111.448 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -98.88 120.14 38.83 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.383 -0.371 . . . . 1.1799999999999999 110.935 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.401 ' HB3' ' CG2' ' A' ' 90' ' ' VAL . 11.4 mt -100.28 -3.59 31.06 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.51 0.93 . . . . 1.04 113.51 -178.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.464 ' ND2' ' CG2' ' A' ' 5' ' ' ILE . 11.3 t-20 -44.69 -28.97 0.68 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.038 0.381 . . . . 0.33000000000000002 111.755 -178.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 37.1 m -84.02 -39.3 19.81 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.575 0.583 . . . . 1.5700000000000001 112.575 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.476 HG12 ' CE2' ' A' ' 50' ' ' TRP . 3.0 m -73.24 -49.22 39.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.946 0.721 . . . . 1.05 112.946 -178.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.456 ' H ' HG22 ' A' ' 90' ' ' VAL . 2.7 mt -85.07 147.58 5.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.655 0.264 . . . . 1.02 110.662 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.479 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 23.5 tt0 -137.49 163.04 32.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.817 -0.438 . . . . 1.1699999999999999 109.817 -179.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -107.12 100.23 9.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.22 0.533 . . . . 0.34000000000000002 110.184 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.407 ' CG2' ' HG3' ' A' ' 99' ' ' LYS . 18.8 t -100.37 98.56 7.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.45 -0.795 . . . . 1.04 111.825 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.3 t0 53.44 33.66 16.47 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.108 0.41 . . . . 0.23999999999999999 112.108 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.76 27.03 15.24 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.638 -0.792 . . . . 0.13 113.08 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -141.85 134.04 27.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.693 0.282 . . . . 1.6100000000000001 110.95 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.479 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 62.6 mt -74.24 122.7 23.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.445 -0.343 . . . . 1.0600000000000001 110.673 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.407 ' HG3' ' CG2' ' A' ' 94' ' ' VAL . 9.6 mttt -122.65 143.07 50.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.976 0.417 . . . . 2.0 111.488 -179.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 45.6 t80 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 115.924 -0.58 . . . . 2.2000000000000002 110.734 179.925 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 15.0 p90 . . . . . 0 N--CA 1.465 0.296 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.415 ' CB ' ' HB3' ' A' ' 67' ' ' SER . 8.0 tp -61.86 -21.28 25.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.609 0.242 . . . . 0.0 111.379 -179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.49 -26.73 51.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.7 0.286 . . . . 0.0 110.615 179.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.0 p -118.75 18.73 13.32 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.814 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.0 m -135.69 153.87 51.46 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.895 0.379 . . . . 0.0 111.165 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 ptm85 -131.46 172.72 11.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.994 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 48.87 58.14 5.65 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.9 p -79.46 134.31 36.53 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.1 pt20 -158.09 163.68 37.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.605 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.42 135.9 38.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.244 0.545 . . . . 0.0 110.944 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.8 144.84 47.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.141 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.58 -152.8 29.93 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 119.739 -1.22 . . . . 0.0 111.486 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.47 -36.86 18.8 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -140.86 35.74 1.77 Allowed 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -178.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -115.87 148.06 40.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.135 0.493 . . . . 0.0 111.951 178.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.405 ' HB2' ' CD1' ' A' ' 64' ' ' ILE . 8.6 tp -121.57 124.95 45.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.184 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.09 144.08 48.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.99 0.424 . . . . 0.0 110.206 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.55 172.47 16.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.851 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -112.02 134.86 53.31 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 176.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 82.5 m -130.71 135.07 47.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.206 0.527 . . . . 0.0 112.337 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.06 135.15 53.22 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.438 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 79.8 p -84.84 -177.7 6.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.366 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -60.37 -30.64 69.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.768 0.318 . . . . 0.0 111.361 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.06 10.34 8.31 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 66.41 36.05 5.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.11 0.481 . . . . 0.0 111.117 -178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -115.94 136.32 53.15 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -93.98 125.08 38.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.122 0.487 . . . . 0.0 112.19 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.9 m -131.46 148.5 32.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.623 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.4 m -69.85 136.59 50.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.219 0.533 . . . . 0.0 111.809 -178.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.9 t -143.24 161.64 37.75 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.03 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -142.92 156.89 44.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.483 0.658 . . . . 0.0 112.226 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -138.08 126.32 30.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.894 -1.048 . . . . 0.0 108.612 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -89.28 118.76 29.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.793 0.33 . . . . 0.0 110.761 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mp -87.99 -14.66 38.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.329 -0.396 . . . . 0.0 112.028 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.438 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.9 p-10 -57.68 -44.39 85.76 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -178.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.438 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 5.9 p30 -92.6 -10.94 35.65 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 122.089 -0.382 . . . . 0.0 111.542 178.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.45 ' CE1' ' CD2' ' A' ' 100' ' ' TYR . 19.6 m-70 -96.69 -66.34 0.91 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.404 ' CD1' ' N ' ' A' ' 41' ' ' ILE . 2.1 mp -81.09 150.47 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.001 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.406 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.1 172.14 13.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.809 -178.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.462 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 20.1 t30 -112.75 111.56 22.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.323 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 41.4 mm -110.82 90.25 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.383 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 66.93 38.97 3.44 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.932 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.01 5.38 89.34 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.778 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.4 m -115.96 135.23 54.17 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.912 0.356 . . . . 0.0 110.522 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 19.4 mt -77.39 118.84 20.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.688 0.756 . . . . 0.0 111.58 -177.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -137.97 162.95 32.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.493 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.437 ' CZ2' HG13 ' A' ' 90' ' ' VAL . 8.5 m-90 -86.79 121.05 28.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.869 0.366 . . . . 0.0 111.28 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.467 ' O ' ' N ' ' A' ' 53' ' ' SER . 32.4 tt0 -174.89 143.06 0.76 Allowed Pre-proline 0 N--CA 1.464 0.267 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.491 -179.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.406 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 31.7 Cg_endo -62.98 68.37 0.14 Allowed 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.336 2.024 . . . . 0.0 112.994 -179.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.467 ' N ' ' O ' ' A' ' 51' ' ' GLN . 4.7 p -158.96 131.73 6.97 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.422 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.71 109.96 15.74 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -177.543 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -48.0 -30.49 4.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.927 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 62.8 p -49.92 -19.04 0.61 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 53.5 mm-40 -61.43 -29.41 69.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.576 0.227 . . . . 0.0 110.895 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.462 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -127.95 0.3 5.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.537 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -113.09 148.09 35.97 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.39 0.614 . . . . 0.0 112.295 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -142.07 157.58 44.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.831 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 64.02 44.87 4.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.99 0.424 . . . . 0.0 110.342 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.2 m -69.16 138.17 53.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.5 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -145.28 153.21 41.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.529 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.405 ' CD1' ' HB2' ' A' ' 19' ' ' LEU . 27.5 mt -129.55 139.4 51.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.193 0.521 . . . . 0.0 111.537 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -133.39 107.92 8.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.172 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.15 -119.73 11.03 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.415 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.2 p -102.91 -3.08 26.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.004 0.402 . . . . 0.0 111.87 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.0 t -102.32 138.87 24.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-O 121.097 0.475 . . . . 0.0 111.962 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.1 tp -100.43 126.17 46.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.914 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.4 m -116.85 124.41 49.45 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.231 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.3 t -152.37 153.85 34.45 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.498 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 10.4 m -93.41 125.9 38.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 90.8 m -124.91 143.95 50.59 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -178.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . 0.412 ' HG3' ' CE1' ' A' ' 80' ' ' TYR . 16.2 tt0 -74.34 136.14 42.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.894 178.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 6.4 mtm180 -91.83 142.55 27.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.685 0.279 . . . . 0.0 110.68 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.8 m -51.9 -27.09 11.73 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.7 -179.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -83.12 2.59 34.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.786 0.327 . . . . 0.0 111.284 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.86 135.85 6.49 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.542 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.27 -170.03 13.11 Favored Glycine 0 C--N 1.318 -0.418 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 -178.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.412 ' CE1' ' HG3' ' A' ' 74' ' ' GLU . 18.3 m-85 -131.86 143.18 49.98 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 117.411 0.605 . . . . 0.0 111.56 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -153.94 130.07 10.36 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.471 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.498 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.6 t -91.86 135.3 34.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.686 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 85.9 p -124.23 158.05 33.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.256 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.75 144.41 49.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.844 0.354 . . . . 0.0 111.092 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.429 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 11.5 tt -144.71 142.56 23.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.291 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -97.63 117.79 32.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.646 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.8 mt -98.54 -5.16 32.66 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -45.37 -27.99 0.78 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 122.151 -0.343 . . . . 0.0 111.754 -178.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.71 -40.38 25.43 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.443 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.3 m -73.47 -53.15 18.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.443 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.1 mp -80.85 147.95 5.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.972 0.415 . . . . 0.0 111.202 -179.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' A' ' 99' ' ' LYS . 15.2 tt0 -138.07 164.63 28.62 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.838 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -106.42 99.66 9.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.309 0.576 . . . . 0.0 110.365 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 39.2 t -98.98 97.14 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.92 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.2 t0 53.98 31.8 14.19 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.68 0.276 . . . . 0.0 111.565 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.11 28.22 11.15 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.794 -0.717 . . . . 0.0 113.414 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 42.5 m -139.76 136.35 34.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.882 0.372 . . . . 0.0 111.138 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 77.0 mt -74.04 119.36 18.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.648 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.418 ' O ' ' N ' ' A' ' 92' ' ' GLU . 4.1 mmmt -125.99 137.14 53.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.984 0.421 . . . . 0.0 111.966 -179.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.45 ' CD2' ' CE1' ' A' ' 40' ' ' HIS . 19.5 t80 . . . . . 0 C--N 1.332 -0.16 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.314 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.439 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 16.1 p90 . . . . . 0 N--CA 1.464 0.228 0 CA-C-O 120.688 0.28 . . . . 0.0 111.545 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.425 ' CB ' ' HB3' ' A' ' 67' ' ' SER . 6.4 tp -62.24 -21.27 26.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.615 0.245 . . . . 0.0 111.389 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -76.66 -27.33 55.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.742 0.306 . . . . 0.0 111.033 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 50.1 p -118.9 18.37 13.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.664 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 77.8 m -131.42 155.08 47.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.057 0.456 . . . . 0.0 111.545 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -132.51 172.95 11.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.889 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.0 p30 48.82 58.1 5.68 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.2 p -79.49 130.77 35.71 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -157.05 163.26 39.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.417 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.492 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.86 136.42 38.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.822 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.06 145.52 46.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.345 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.27 -152.28 33.78 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.788 -1.196 . . . . 0.0 111.325 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.19 -37.17 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.452 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.63 35.36 1.63 Allowed 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.8 OUTLIER -113.71 147.9 37.36 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.937 0.399 . . . . 0.0 111.662 179.016 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 11.4 tp -120.11 123.61 43.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.397 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.63 143.69 48.54 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.49 172.51 16.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.214 -178.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -110.07 134.12 52.49 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 75.0 m -130.67 132.91 45.68 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.385 -0.526 . . . . 0.0 112.082 -178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.5 ptpt -66.93 136.33 55.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.357 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 71.2 p -85.21 -176.91 6.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.49 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -62.29 -29.71 70.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.229 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.96 10.35 8.1 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 66.9 38.36 3.68 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.12 0.486 . . . . 0.0 111.511 -178.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.451 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 3.0 mm-40 -118.28 135.92 54.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.979 178.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -93.07 124.85 37.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.8 0.333 . . . . 0.0 111.444 -178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.5 m -130.99 151.78 36.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.896 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.8 p -71.5 134.29 46.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.173 0.511 . . . . 0.0 111.916 -178.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 t -144.17 161.37 39.04 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.368 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -143.7 156.64 44.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.298 0.571 . . . . 0.0 111.893 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -136.57 127.59 42.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.302 -0.863 . . . . 0.0 108.977 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -87.49 116.98 25.98 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.699 0.285 . . . . 0.0 111.531 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.424 ' O ' ' N ' ' A' ' 41' ' ' ILE . 3.9 mp -87.59 -14.84 39.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.91 179.106 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.433 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -56.59 -48.24 77.82 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.297 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.418 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -90.96 -10.08 43.68 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 122.13 -0.356 . . . . 0.0 111.384 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 -95.21 -62.98 1.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.424 ' N ' ' O ' ' A' ' 37' ' ' LEU . 22.7 mm -80.73 151.04 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.839 178.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.415 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -140.91 172.23 12.97 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.107 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.485 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 34.3 t30 -112.18 108.85 18.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.682 -179.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 50.8 mm -109.64 89.78 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.315 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 43.9 t0 66.21 38.05 4.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.332 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.25 0.63 88.55 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.182 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.4 m -112.08 137.36 50.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.924 0.393 . . . . 0.0 111.003 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 26.8 mt -76.95 117.5 18.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.705 0.764 . . . . 0.0 111.565 -177.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -138.44 162.86 33.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.836 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.476 ' CZ2' ' CG1' ' A' ' 90' ' ' VAL . 4.0 m-90 -84.86 123.13 30.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.039 0.447 . . . . 0.0 111.865 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -172.17 147.17 1.8 Allowed Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.255 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.418 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 51.6 Cg_endo -69.65 63.7 1.73 Allowed 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.231 1.954 . . . . 0.0 112.305 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.415 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.1 p -158.28 135.15 9.79 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.32 179.111 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.01 109.71 15.86 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.452 ' CZ ' ' CB ' ' A' ' 17' ' ' SER . 37.6 p90 -48.92 -29.4 4.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.466 178.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.3 p -48.31 -17.89 0.18 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.883 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -63.75 -29.01 70.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.623 0.249 . . . . 0.0 111.39 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.485 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -127.51 -0.94 6.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.473 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.7 m -110.53 147.97 33.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.202 0.525 . . . . 0.0 111.931 -178.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.7 p90 -142.29 157.61 44.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.045 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.6 m120 64.14 47.29 3.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.947 0.403 . . . . 0.0 110.856 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.1 m -70.79 135.03 47.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.689 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.12 150.36 42.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.575 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.492 HG13 ' HB2' ' A' ' 13' ' ' LEU . 33.6 mt -128.68 138.76 53.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.376 0.608 . . . . 0.0 111.891 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -136.09 108.19 7.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.16 -0.927 . . . . 0.0 108.963 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.53 -121.36 11.01 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.442 -0.885 . . . . 0.0 111.449 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.425 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.2 p -101.68 -4.17 26.98 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 t -101.41 140.37 20.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.033 0.444 . . . . 0.0 111.99 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.7 tp -102.49 125.97 49.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.349 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.1 m -116.11 124.69 51.0 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.5 t -151.79 153.77 34.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.704 0.287 . . . . 0.0 111.485 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 18.8 m -94.83 126.22 40.01 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 178.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 88.1 m -125.95 144.98 50.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.351 0.596 . . . . 0.0 112.37 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -74.26 137.43 42.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.914 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -91.93 142.5 27.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.665 0.269 . . . . 0.0 110.446 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 56.4 m -52.14 -26.8 12.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.539 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -83.43 2.03 38.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.579 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.45 134.99 6.87 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.774 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.09 -169.14 12.76 Favored Glycine 0 C--N 1.319 -0.41 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -131.04 143.31 50.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 117.337 0.568 . . . . 0.0 111.308 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -153.9 128.85 9.53 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.167 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.7 t -91.97 134.71 34.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.495 -179.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 21.8 p -121.96 158.03 29.97 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.276 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.6 p -123.2 145.02 48.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.878 0.371 . . . . 0.0 110.978 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.471 HD11 HG21 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -146.99 145.03 19.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.628 -179.822 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -98.56 117.91 34.07 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.244 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.434 ' O ' HG21 ' A' ' 90' ' ' VAL . 6.3 mt -100.1 -6.47 26.26 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.439 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 7.0 t-20 -45.01 -27.04 0.5 Allowed 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -178.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.7 m -80.26 -38.34 31.11 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.476 ' CG1' ' CZ2' ' A' ' 50' ' ' TRP . 3.2 m -75.49 -51.83 19.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -178.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.442 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -81.57 147.49 6.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.034 0.445 . . . . 0.0 111.247 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.43 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 23.1 tt0 -139.08 167.0 23.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.266 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -106.26 99.56 9.14 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.18 0.514 . . . . 0.0 110.378 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.416 ' CG2' ' HG3' ' A' ' 99' ' ' LYS . 58.6 t -97.95 96.51 5.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.999 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.5 t0 53.45 32.84 14.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.632 0.253 . . . . 0.0 111.515 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.44 28.38 11.59 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.831 -0.7 . . . . 0.0 113.345 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.7 m -141.1 135.06 30.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 0.0 111.009 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.43 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 54.1 mt -73.39 119.94 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.759 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.3 mttm -123.81 133.95 53.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.467 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.403 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 36.6 t80 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.34 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.438 ' CE2' ' HA ' ' A' ' 88' ' ' ASN . 22.8 p90 . . . . . 0 N--CA 1.466 0.333 0 N-CA-C 111.617 0.229 . . . . 0.0 111.617 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.428 ' O ' HG13 ' A' ' 5' ' ' ILE . 3.8 tp -64.43 -18.16 22.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.674 0.274 . . . . 0.0 111.272 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.31 -24.19 60.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.873 0.368 . . . . 0.0 110.577 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.4 p -118.46 -3.77 10.9 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.682 179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.8 m -108.19 152.58 24.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.966 0.412 . . . . 0.0 111.482 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -132.09 172.42 12.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.751 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.403 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 6.2 p-10 48.43 58.05 5.6 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 66.9 p -79.67 132.75 36.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.319 178.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -158.71 163.95 36.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.192 -179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.462 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.42 136.38 37.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.147 0.499 . . . . 0.0 110.863 -179.666 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.22 143.81 47.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.098 179.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.29 -152.78 32.9 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 119.89 -1.147 . . . . 0.0 111.462 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -85.83 -37.09 19.59 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.454 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -141.43 36.23 1.67 Allowed 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 8.2 mp0 -115.83 146.67 41.78 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.808 0.337 . . . . 0.0 111.81 178.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.404 ' N ' ' CD1' ' A' ' 37' ' ' LEU . 10.7 tp -119.86 124.76 46.86 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.21 142.66 47.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.2 172.72 16.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.189 -178.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -115.45 133.54 55.93 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 177.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.7 m -130.77 135.66 47.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.077 0.465 . . . . 0.0 111.62 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.7 ptpt -66.88 136.93 56.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.675 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 42.4 p -84.91 -176.92 6.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.696 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.8 mmt-85 -61.48 -30.48 70.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.801 0.334 . . . . 0.0 110.995 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.12 9.17 9.05 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 66.99 38.81 3.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.317 0.579 . . . . 0.0 111.099 -178.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.422 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 60.8 mt-30 -119.42 134.89 54.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.283 -0.872 . . . . 0.0 108.872 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -93.09 124.65 37.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.972 0.415 . . . . 0.0 111.544 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.1 m -130.36 153.58 39.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.811 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.24 134.46 44.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.27 0.557 . . . . 0.0 112.186 -178.478 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.8 t -143.59 161.21 39.08 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.28 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.0 ttmt -142.86 156.73 44.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.341 0.591 . . . . 0.0 111.887 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.417 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.1 tp -135.03 128.05 49.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.017 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -88.33 115.42 25.82 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.626 0.25 . . . . 0.0 111.296 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.1 mp -86.59 -15.44 39.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.344 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.422 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -57.09 -45.22 83.53 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 -178.757 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.402 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 1.3 p30 -91.89 -10.41 39.73 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.477 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 26.8 m-70 -98.33 -63.33 1.14 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.454 ' CD1' ' CD1' ' A' ' 50' ' ' TRP . 20.6 mm -80.6 147.73 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.952 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -141.07 172.24 12.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.526 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.458 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 25.9 t30 -113.11 111.72 22.61 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.164 -179.189 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.407 ' CD1' ' HB2' ' A' ' 49' ' ' LYS . 3.0 mp -112.01 89.34 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.909 0.385 . . . . 0.0 111.032 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.7 t0 67.78 38.26 2.97 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.258 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.75 0.88 87.57 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.564 -0.827 . . . . 0.0 113.424 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.4 m -110.72 135.41 51.36 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.307 0.554 . . . . 0.0 110.893 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.7 mt -77.63 118.76 20.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.454 0.645 . . . . 0.0 111.249 -178.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.407 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 28.2 mttt -138.99 163.24 32.89 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.514 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.454 ' CD1' ' CD1' ' A' ' 41' ' ' ILE . 7.7 m-90 -85.89 118.68 25.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.133 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.407 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 43.0 tt0 -174.66 143.14 0.8 Allowed Pre-proline 0 N--CA 1.465 0.31 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.005 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.407 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 28.4 Cg_endo -64.55 74.67 0.2 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.093 1.862 . . . . 0.0 113.164 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -165.75 135.19 3.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.348 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.464 ' N ' ' OD1' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.69 109.31 15.98 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -177.688 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 38.6 p90 -50.0 -28.41 6.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.808 178.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.1 p -49.32 -16.99 0.21 Allowed 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -63.92 -29.62 70.78 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 122.16 -0.338 . . . . 0.0 111.351 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.458 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -128.2 1.04 5.8 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.073 -0.251 . . . . 0.0 111.479 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.4 m -111.81 147.66 35.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.231 0.538 . . . . 0.0 112.095 -178.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -143.63 157.72 44.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.886 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 64.15 46.33 3.69 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.029 0.442 . . . . 0.0 110.89 -179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 35.8 m -70.53 137.6 50.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.097 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.66 151.67 41.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.986 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.462 HG13 ' HB2' ' A' ' 13' ' ' LEU . 54.4 mt -130.66 138.77 52.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 121.325 0.583 . . . . 0.0 111.889 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -136.03 111.26 9.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.273 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.82 -121.1 13.65 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.122 -1.037 . . . . 0.0 110.734 -178.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.5 p -103.07 -3.21 26.25 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.6 t -100.97 138.19 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 121.028 0.442 . . . . 0.0 111.937 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.8 tp -102.49 124.37 47.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.142 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.5 m -115.67 126.92 54.75 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 t -152.01 153.86 34.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.768 0.318 . . . . 0.0 111.455 -179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.2 m -93.9 126.13 38.92 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.0 m -126.88 144.93 50.84 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.467 0.651 . . . . 0.0 112.508 -178.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -74.64 137.32 42.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.605 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -90.73 144.72 25.44 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.7 m -51.46 -26.46 8.23 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -83.17 3.07 32.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.634 0.254 . . . . 0.0 111.489 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.32 138.47 7.34 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.089 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.77 -169.83 13.09 Favored Glycine 0 C--N 1.318 -0.448 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -129.5 140.42 51.27 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 117.196 0.498 . . . . 0.0 111.066 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -154.01 128.93 9.49 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.406 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.6 t -93.41 134.87 35.2 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.916 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 37.6 p -121.98 158.3 29.41 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.516 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -122.12 144.52 48.89 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.662 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.6 tt -145.67 142.58 21.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.605 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -97.38 121.11 38.91 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.078 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.2 mt -100.58 -4.16 29.1 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -178.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.438 ' HA ' ' CE2' ' A' ' 4' ' ' PHE . 13.1 t-20 -44.75 -28.44 0.63 Allowed 'General case' 0 N--CA 1.468 0.436 0 O-C-N 122.097 -0.377 . . . . 0.0 111.756 -178.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 49.1 m -81.64 -41.78 20.95 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.47 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.3 m -72.13 -52.75 22.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -177.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.47 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -81.99 145.49 8.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.108 0.48 . . . . 0.0 111.47 -178.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -135.96 166.25 23.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.062 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -107.95 99.53 8.98 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.27 0.557 . . . . 0.0 110.169 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.2 t -97.63 96.68 5.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.693 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 22.1 t0 53.42 33.18 15.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.613 0.244 . . . . 0.0 111.599 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.12 28.52 11.67 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.508 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.2 t -140.55 135.33 31.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.901 0.351 . . . . 0.0 110.875 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.417 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 55.6 mt -74.27 120.47 19.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.869 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -127.01 138.09 53.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.892 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.477 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 15.0 t80 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.845 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.439 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 17.0 p90 . . . . . 0 N--CA 1.464 0.262 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.433 ' CB ' ' HB3' ' A' ' 67' ' ' SER . 6.8 tp -61.83 -22.56 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-O 120.679 0.276 . . . . 0.0 111.498 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -75.24 -24.53 57.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.069 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.8 p -118.05 -3.69 11.09 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 58.2 m -111.14 155.17 23.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.882 0.373 . . . . 0.0 111.069 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -130.22 172.43 11.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.79 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 48.08 59.52 4.19 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 16.6 p -78.78 132.21 36.82 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 178.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -157.43 163.62 38.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.938 0.399 . . . . 0.0 111.79 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.421 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.47 136.49 37.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.706 179.601 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.86 146.48 46.53 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.223 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.64 -153.15 25.12 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 119.771 -1.204 . . . . 0.0 111.365 -178.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.7 m -85.52 -36.95 20.18 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -140.81 36.11 1.79 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -115.23 149.64 37.41 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.153 0.501 . . . . 0.0 112.172 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.403 ' HB2' HD11 ' A' ' 37' ' ' LEU . 19.4 tp -122.45 123.06 40.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.239 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.02 143.98 46.79 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.47 172.82 15.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.302 -178.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -110.98 133.99 52.95 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 61.4 m -130.8 132.08 45.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.052 0.453 . . . . 0.0 111.92 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.11 137.0 56.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.411 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 53.3 p -87.3 -177.74 6.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.516 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.9 mmt85 -62.2 -28.94 70.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.557 0.218 . . . . 0.0 111.288 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.36 8.39 9.34 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 66.66 38.0 4.15 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.263 0.554 . . . . 0.0 110.653 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -118.88 136.08 54.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.977 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -92.69 124.74 36.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.931 0.396 . . . . 0.0 111.452 -178.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.2 m -129.81 148.67 33.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.417 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.5 t -71.61 137.15 47.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.179 0.514 . . . . 0.0 111.946 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 t -145.97 162.35 38.01 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.643 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -143.88 155.84 44.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.316 0.579 . . . . 0.0 112.043 -179.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.413 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.1 tp -135.26 127.77 47.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -89.1 118.6 28.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.72 0.295 . . . . 0.0 110.863 -177.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.403 HD11 ' HB2' ' A' ' 19' ' ' LEU . 3.7 mp -88.96 -16.11 32.57 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.852 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.401 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.1 p-10 -56.57 -43.93 80.47 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -178.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.415 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.3 OUTLIER -92.71 -10.59 36.58 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 122.201 -0.312 . . . . 0.0 111.601 178.92 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 -96.65 -64.92 1.0 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.419 HD13 ' CD1' ' A' ' 50' ' ' TRP . 23.2 mm -80.93 148.49 5.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.734 178.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.41 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -138.52 172.26 13.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.84 -179.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.412 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 30.0 t30 -111.96 109.59 19.45 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.464 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.4 HG22 HD13 ' A' ' 44' ' ' ILE . 37.8 mm -109.54 88.98 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.678 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 49.8 t0 67.17 39.68 3.03 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.255 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.48 0.75 88.11 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.829 -0.7 . . . . 0.0 113.439 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 39.1 m -113.78 138.23 50.54 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.033 0.444 . . . . 0.0 111.429 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.6 mt -77.17 117.17 18.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.645 0.736 . . . . 0.0 111.118 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 46.4 mttt -135.84 162.49 32.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.859 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.462 ' CZ2' HG11 ' A' ' 90' ' ' VAL . 4.9 m-90 -85.33 118.04 24.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.966 0.412 . . . . 0.0 111.149 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.408 ' O ' ' N ' ' A' ' 53' ' ' SER . 29.2 tt0 -173.04 142.25 1.02 Allowed Pre-proline 0 N--CA 1.465 0.324 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.705 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.415 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 34.3 Cg_endo -64.97 73.29 0.23 Allowed 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 121.968 1.779 . . . . 0.0 112.455 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.1 p -162.85 134.57 5.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.69 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.23 109.34 16.42 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -48.5 -30.74 5.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.876 178.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.2 p -49.14 -17.82 0.26 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -178.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -62.02 -28.66 69.74 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.136 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.412 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.5 p -128.56 -0.09 5.55 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.387 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.2 m -110.69 148.8 31.52 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -141.1 156.97 45.9 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.248 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 62.96 46.53 4.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.98 0.419 . . . . 0.0 110.632 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.0 m -69.31 135.96 51.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.188 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.16 152.57 41.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.673 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.421 HG13 ' HB2' ' A' ' 13' ' ' LEU . 52.4 mt -129.83 140.1 49.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.284 0.564 . . . . 0.0 111.905 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -135.23 108.83 7.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.257 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.18 -120.95 14.55 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.445 -0.883 . . . . 0.0 111.012 -178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.433 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.5 p -100.85 -3.17 30.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.144 0.472 . . . . 0.0 111.858 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.3 t -101.95 138.51 25.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-O 121.01 0.433 . . . . 0.0 111.922 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.6 tp -101.13 124.92 47.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.394 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.9 m -115.16 125.12 53.05 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.2 t -151.94 154.09 35.38 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.616 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.9 m -93.88 125.81 38.72 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 84.8 m -127.95 145.3 51.01 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 -178.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -75.63 136.47 40.46 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.585 178.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -92.21 146.01 24.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.669 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.3 m -51.79 -27.38 12.12 Favored 'General case' 0 N--CA 1.462 0.155 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -82.95 2.3 35.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.524 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.95 137.79 6.83 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.417 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.19 -169.46 12.89 Favored Glycine 0 C--N 1.319 -0.396 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -178.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -132.03 142.18 49.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.282 0.541 . . . . 0.0 111.15 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -154.32 128.28 8.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.124 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.0 OUTLIER -91.61 134.16 34.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.264 -179.479 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 p -119.29 158.27 26.39 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.588 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 4.4 p -120.15 142.75 48.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.818 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.457 HD13 ' CZ2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -148.07 144.95 18.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.529 179.736 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -100.79 120.73 40.54 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.585 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.1 mt -102.02 -3.25 27.98 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -179.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.423 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 6.3 t-20 -45.0 -26.96 0.49 Allowed 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.2 m -80.22 -42.17 23.79 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.462 HG11 ' CZ2' ' A' ' 50' ' ' TRP . 3.7 m -71.63 -52.9 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -178.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.447 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.2 mp -80.53 147.68 6.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.945 0.402 . . . . 0.0 111.342 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.402 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 12.9 tt0 -139.46 167.2 22.63 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.473 -178.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -105.8 99.5 9.1 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.997 0.427 . . . . 0.0 110.639 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.2 t -100.34 94.87 3.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.787 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 20.5 t0 55.36 32.58 19.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.674 0.273 . . . . 0.0 111.448 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.28 27.87 14.57 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.915 -0.659 . . . . 0.0 113.204 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.3 t -139.05 134.02 32.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.73 0.3 . . . . 0.0 111.059 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.413 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 78.2 mt -72.74 118.78 16.09 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.945 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -124.74 140.5 52.88 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 32.5 t80 . . . . . 0 C--N 1.332 -0.182 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.014 178.998 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.428 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 18.3 p90 . . . . . 0 N--CA 1.464 0.251 0 CA-C-O 120.702 0.287 . . . . 0.0 111.349 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.413 ' CB ' ' HB3' ' A' ' 67' ' ' SER . 6.7 tp -66.24 -13.18 15.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -77.54 -26.82 51.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.891 0.377 . . . . 0.0 110.878 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.2 p -118.56 0.34 11.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.528 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 76.0 m -112.31 153.44 27.21 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 121.015 0.436 . . . . 0.0 111.047 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.8 ptt180 -132.57 172.6 12.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.989 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 48.91 58.0 5.82 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 p -79.32 131.64 36.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.979 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -155.97 163.01 40.27 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.4 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.511 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.5 OUTLIER -97.42 135.79 38.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.546 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.42 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.86 144.34 47.43 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.272 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.38 -151.71 31.34 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 119.799 -1.191 . . . . 0.0 111.3 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.65 -37.06 18.38 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -140.54 35.44 1.83 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.4 mp0 -115.15 146.89 40.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.059 0.457 . . . . 0.0 111.781 179.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.411 ' HB2' HD13 ' A' ' 37' ' ' LEU . 14.6 tp -122.04 124.25 43.52 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.014 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.81 144.07 46.54 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.935 0.398 . . . . 0.0 110.141 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.31 172.35 16.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.17 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -114.57 134.05 55.34 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 177.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 55.7 m -130.57 134.15 46.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.281 0.563 . . . . 0.0 111.894 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.2 ptpt -66.04 137.48 57.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.423 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.0 p -85.9 -176.43 5.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.644 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -62.93 -30.56 71.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.231 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.81 9.68 7.61 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 66.88 37.67 3.94 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.132 0.492 . . . . 0.0 111.425 -178.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.428 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 54.4 mt-30 -117.25 137.69 52.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.009 177.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -94.85 125.06 39.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.859 0.361 . . . . 0.0 111.849 -178.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 m -131.04 151.05 35.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.0 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.7 p -71.92 135.8 46.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.246 0.546 . . . . 0.0 111.876 -178.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.4 t -143.26 161.42 38.33 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.214 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.4 ttmt -142.2 156.1 45.31 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.411 0.624 . . . . 0.0 111.933 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.419 HG12 HG12 ' A' ' 91' ' ' ILE . 1.3 tp -138.42 125.0 26.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.115 -0.948 . . . . 0.0 108.818 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -86.8 119.13 26.7 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.677 0.275 . . . . 0.0 111.153 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.418 ' O ' ' N ' ' A' ' 41' ' ' ILE . 4.4 mp -87.99 -16.0 34.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.634 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.444 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -57.69 -44.81 86.11 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.444 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.4 OUTLIER -91.76 -10.4 40.11 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 122.106 -0.371 . . . . 0.0 111.061 179.285 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 23.6 m-70 -97.87 -68.43 0.8 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.436 ' N ' ' CD1' ' A' ' 41' ' ' ILE . 1.7 mp -78.59 150.67 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.287 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.421 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.09 172.58 12.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.953 -179.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.491 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 26.8 t30 -111.34 109.45 19.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.083 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 33.3 mm -109.88 89.69 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.407 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 55.6 t0 68.0 38.78 2.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.259 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.16 0.7 89.61 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.824 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.9 m -112.81 136.94 51.85 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.863 0.363 . . . . 0.0 110.882 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.5 mt -77.41 117.39 18.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.638 0.733 . . . . 0.0 111.281 -178.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.1 mttm -137.51 162.7 33.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.721 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.472 ' CE2' HG13 ' A' ' 90' ' ' VAL . 9.2 m-90 -87.27 121.89 30.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.087 0.47 . . . . 0.0 111.561 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 53' ' ' SER . 3.2 tp60 -175.06 143.39 0.76 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.873 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.42 ' HD2' ' HG3' ' A' ' 51' ' ' GLN . 23.4 Cg_endo -62.41 69.43 0.12 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.208 1.939 . . . . 0.0 112.553 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -160.49 134.75 7.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.834 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.431 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -82.49 108.42 15.88 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.158 0.504 . . . . 0.0 112.027 -178.068 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.419 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 33.4 p90 -47.63 -31.33 4.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.301 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 45.8 p -47.78 -16.25 0.07 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.316 -0.857 . . . . 0.0 113.006 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -64.56 -26.83 68.59 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.559 0.219 . . . . 0.0 111.381 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.491 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -134.01 5.41 3.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.322 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.6 m -115.18 148.98 38.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.228 0.537 . . . . 0.0 111.837 -178.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -142.84 157.63 44.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.968 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.4 m-20 63.34 46.07 4.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.981 0.42 . . . . 0.0 110.954 -179.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 43.2 m -69.59 136.02 50.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.496 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.33 151.03 43.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.511 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.511 HG13 ' HB2' ' A' ' 13' ' ' LEU . 52.2 mt -129.81 140.89 47.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.225 0.536 . . . . 0.0 111.728 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -138.13 110.4 7.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.01 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.36 -122.28 14.77 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.269 -0.967 . . . . 0.0 111.101 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.413 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.3 p -101.32 -2.37 31.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.5 t -102.63 138.62 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.012 0.434 . . . . 0.0 112.109 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.432 HD11 ' N ' ' A' ' 70' ' ' THR . 8.7 tp -102.53 126.93 49.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.329 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.432 ' N ' HD11 ' A' ' 69' ' ' LEU . 3.1 m -117.56 125.95 51.72 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.4 t -151.83 153.43 34.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.607 0.241 . . . . 0.0 111.16 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 18.5 m -94.2 126.02 39.18 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 85.4 m -126.45 145.15 50.6 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -74.51 136.52 42.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.772 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.1 mtm180 -91.72 143.61 26.37 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 69.2 m -51.83 -27.23 11.82 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -83.67 2.28 38.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.65 0.262 . . . . 0.0 111.531 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.81 136.95 7.4 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.911 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.96 -169.73 13.07 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 111.101 -0.8 . . . . 0.0 111.101 -178.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -130.8 142.04 50.38 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 117.304 0.552 . . . . 0.0 111.22 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -154.15 129.13 9.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.517 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -92.75 134.33 35.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.271 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.3 p -122.77 158.18 30.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.377 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 57.8 p -121.01 144.88 48.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.906 0.384 . . . . 0.0 111.059 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 13.5 tt -144.21 143.0 23.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.399 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -96.88 115.86 28.17 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.995 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.417 ' O ' HG22 ' A' ' 90' ' ' VAL . 16.1 mt -95.91 -7.19 37.38 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.428 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 13.9 t-20 -44.7 -27.83 0.54 Allowed 'General case' 0 N--CA 1.467 0.392 0 O-C-N 122.178 -0.326 . . . . 0.0 111.869 -178.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.88 -37.88 26.22 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.472 HG13 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -74.36 -53.87 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 -178.181 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.46 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -80.95 147.78 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.05 0.452 . . . . 0.0 111.465 -178.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.411 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 14.4 tt0 -138.07 164.45 29.08 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.852 -178.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 20.8 t30 -106.67 99.72 9.28 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.087 0.47 . . . . 0.0 110.528 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.439 ' HB ' ' CE ' ' A' ' 99' ' ' LYS . 39.1 t -99.86 96.65 5.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.187 179.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 19.2 t0 53.62 33.0 15.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.66 28.79 13.23 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.697 -0.763 . . . . 0.0 113.054 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -141.91 134.33 28.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.746 0.308 . . . . 0.0 110.925 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.411 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 49.8 mt -75.06 119.14 18.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.12 0.486 . . . . 0.0 111.51 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.439 ' CE ' ' HB ' ' A' ' 94' ' ' VAL . 0.9 OUTLIER -122.85 153.41 39.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.084 179.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 53.9 t80 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.928 -179.792 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.437 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 19.6 p90 . . . . . 0 N--CA 1.465 0.284 0 CA-C-O 120.645 0.26 . . . . 0.0 111.543 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.405 ' CB ' ' HB3' ' A' ' 67' ' ' SER . 7.8 tp -63.02 -19.84 24.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.673 0.273 . . . . 0.0 111.393 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -78.48 -26.37 46.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.766 0.317 . . . . 0.0 110.726 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.6 p -118.32 13.83 13.71 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.984 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.9 m -129.77 156.2 44.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.933 0.397 . . . . 0.0 111.167 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.34 172.5 12.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.034 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 47.98 58.56 4.95 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.0 p -79.06 132.79 36.73 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -157.36 163.81 38.22 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.973 0.416 . . . . 0.0 111.453 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.454 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.5 OUTLIER -97.49 136.1 38.4 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.035 -179.835 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -118.6 143.45 46.79 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.04 -150.75 31.93 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 119.877 -1.154 . . . . 0.0 111.712 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -87.21 -36.62 17.87 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -178.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.404 ' OG ' ' HB3' ' A' ' 38' ' ' ASP . 3.1 p -140.69 35.07 1.8 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 3.0 mp0 -115.45 148.02 39.9 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.205 0.526 . . . . 0.0 112.123 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 11.8 tp -122.06 123.83 42.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.319 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.29 143.61 47.25 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.19 172.33 16.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.081 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -111.27 133.56 53.51 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 86.1 m -131.01 134.2 46.47 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.416 -0.514 . . . . 0.0 112.277 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.3 ptpt -67.11 137.42 56.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.728 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 36.2 p -86.05 -178.96 6.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.602 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -61.41 -29.13 69.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.709 0.29 . . . . 0.0 111.222 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.16 10.41 8.35 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 66.51 36.33 5.07 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.138 0.494 . . . . 0.0 111.345 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -116.42 137.61 52.02 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -93.92 125.3 38.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.945 0.402 . . . . 0.0 111.864 -178.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.4 m -131.0 150.74 34.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.696 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -72.53 135.96 45.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.145 0.498 . . . . 0.0 111.968 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.6 t -143.7 161.38 38.73 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.208 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -141.93 157.24 45.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.509 0.671 . . . . 0.0 112.283 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.3 tp -138.47 125.79 27.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.076 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -87.88 119.13 27.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.664 0.268 . . . . 0.0 110.998 -178.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.412 ' O ' ' N ' ' A' ' 41' ' ' ILE . 4.1 mp -88.31 -14.54 38.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.5 p-10 -58.49 -43.46 89.02 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.455 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.9 OUTLIER -92.16 -10.94 36.97 Favored 'General case' 0 N--CA 1.465 0.306 0 O-C-N 122.096 -0.377 . . . . 0.0 111.8 179.568 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.451 ' CE1' ' CD2' ' A' ' 100' ' ' TYR . 38.9 m-70 -97.8 -59.77 1.7 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.412 ' N ' ' O ' ' A' ' 37' ' ' LEU . 32.5 mm -81.28 146.16 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.575 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.456 ' HB2' ' HB2' ' A' ' 51' ' ' GLN . . . -139.02 170.34 16.16 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.298 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.449 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 29.8 t30 -112.95 109.68 19.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.53 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.2 mm -110.02 89.6 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.069 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.4 t0 68.52 39.43 2.13 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.089 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.28 5.57 89.5 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.864 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 m -115.23 136.42 53.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.793 0.33 . . . . 0.0 110.821 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.8 mt -77.53 116.15 17.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.666 0.746 . . . . 0.0 111.333 -178.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 mmtt -136.34 162.63 32.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.192 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.411 ' CE2' HG12 ' A' ' 90' ' ' VAL . 7.7 m-90 -86.07 123.47 31.41 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.323 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.456 ' HB2' ' HB2' ' A' ' 42' ' ' ALA . 2.8 mt-30 -172.03 152.6 2.95 Favored Pre-proline 0 N--CA 1.465 0.323 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.773 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.06 63.26 4.14 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.023 1.815 . . . . 0.0 112.359 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.425 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 4.4 p -155.92 135.03 12.11 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.506 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -81.22 109.56 15.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.182 0.515 . . . . 0.0 112.259 -177.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -47.3 -30.59 3.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.708 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 81.9 p -48.58 -18.12 0.22 Allowed 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -61.21 -28.07 68.89 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.933 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.449 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 6.1 p -130.7 1.34 4.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.3 m -111.47 149.18 31.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.192 0.52 . . . . 0.0 112.336 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.6 p90 -141.55 156.56 45.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.817 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 63.98 47.22 3.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.884 0.373 . . . . 0.0 111.242 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.4 m -69.92 134.89 48.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.453 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.72 152.14 43.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.599 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.454 HG13 ' HB2' ' A' ' 13' ' ' LEU . 39.5 mt -128.92 138.06 55.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.4 0.619 . . . . 0.0 112.034 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -133.77 106.46 7.35 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.079 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.31 -121.89 11.96 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.49 -0.862 . . . . 0.0 111.58 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.405 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 24.3 p -99.41 -4.4 31.61 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.5 t -102.04 140.51 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 121.109 0.48 . . . . 0.0 112.191 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.3 tp -102.55 126.12 49.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.085 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.0 m -116.0 125.29 52.3 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.218 -0.289 . . . . 0.0 110.218 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.6 t -152.02 153.59 34.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.612 0.244 . . . . 0.0 111.353 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 22.1 m -95.05 126.44 40.39 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 76.6 m -126.02 145.06 50.47 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -74.5 136.58 42.21 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.848 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -93.2 144.37 25.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.691 0.282 . . . . 0.0 111.119 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.3 m -52.02 -28.83 18.49 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.635 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -82.61 1.7 36.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.638 0.256 . . . . 0.0 111.479 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.07 136.15 7.19 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.707 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.5 -170.91 13.47 Favored Glycine 0 C--N 1.319 -0.392 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 -178.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -129.54 143.12 50.69 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 117.286 0.543 . . . . 0.0 111.059 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -153.81 130.13 10.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.174 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.9 t -92.7 134.89 34.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.636 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 26.4 p -122.21 157.79 30.83 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.197 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.1 p -123.69 145.09 49.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.861 0.362 . . . . 0.0 111.086 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.3 tt -146.34 142.79 21.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.762 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -96.77 118.31 32.94 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.131 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.403 ' O ' HG23 ' A' ' 90' ' ' VAL . 9.5 mt -97.4 -6.82 33.18 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.413 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 9.3 t-20 -45.06 -28.7 0.74 Allowed 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -178.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.9 m -80.59 -40.67 25.34 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.46 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 2.7 m -72.8 -50.82 30.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 113.067 0.765 . . . . 0.0 113.067 -178.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.46 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -82.93 147.35 5.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.137 0.494 . . . . 0.0 111.461 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.406 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 4.9 tt0 -138.96 166.83 23.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.96 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -108.02 99.91 9.3 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.059 0.457 . . . . 0.0 110.743 -179.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.2 t -99.17 96.88 5.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.848 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.0 t0 52.6 33.67 14.1 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.37 28.35 11.72 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.579 -0.82 . . . . 0.0 113.3 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -140.99 134.11 29.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.907 0.384 . . . . 0.0 111.2 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.406 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 59.3 mt -73.5 119.56 17.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.529 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 2.3 mmmt -125.18 141.75 51.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.194 0.521 . . . . 0.0 111.985 -179.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.451 ' CD2' ' CE1' ' A' ' 40' ' ' HIS . 46.1 t80 . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.659 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.447 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 31.0 p90 . . . . . 0 N--CA 1.464 0.253 0 CA-C-O 120.724 0.297 . . . . 0.0 111.127 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.408 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 6.8 tp -63.87 -17.63 20.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.736 0.303 . . . . 0.0 111.161 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.62 -26.47 54.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.959 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.0 p -118.67 18.59 13.4 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.183 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.3 m -134.41 154.91 51.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.968 0.413 . . . . 0.0 111.063 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.412 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 1.6 ptm180 -134.25 172.8 12.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.19 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.412 ' OD1' ' O ' ' A' ' 9' ' ' ARG . 6.3 p-10 49.04 57.4 6.5 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.3 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.2 p -79.58 134.14 36.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.88 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -158.35 163.66 37.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.388 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.468 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.31 135.85 38.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.156 0.503 . . . . 0.0 110.73 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.28 146.12 46.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.085 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.78 -153.33 25.31 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.814 -1.184 . . . . 0.0 111.408 -179.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.0 -36.85 19.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -141.04 36.23 1.74 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -116.05 146.09 42.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.168 0.509 . . . . 0.0 111.881 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 15.2 tp -120.89 125.07 46.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.175 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.6 143.93 47.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.858 0.361 . . . . 0.0 110.031 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.28 172.51 16.51 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.386 -178.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.15 133.54 54.23 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.2 m -130.77 132.82 45.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.158 0.504 . . . . 0.0 112.043 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.1 ptpt -66.52 135.73 54.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.105 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.0 p -85.89 -176.28 5.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.633 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.1 mtt-85 -61.46 -29.91 70.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.742 0.306 . . . . 0.0 111.257 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.76 8.86 9.0 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 66.53 37.06 4.69 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.169 0.509 . . . . 0.0 111.059 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.41 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.0 OUTLIER -118.24 136.33 53.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.995 178.103 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -92.64 125.47 37.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.921 0.391 . . . . 0.0 111.858 -178.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.1 m -129.87 152.56 37.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.828 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.4 t -72.75 133.54 44.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.178 0.513 . . . . 0.0 111.592 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -142.11 161.37 38.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.272 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -142.5 154.99 45.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.407 0.622 . . . . 0.0 112.206 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -136.41 124.87 36.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.821 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -88.64 120.29 29.9 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.683 0.278 . . . . 0.0 111.036 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.5 mp -88.05 -14.52 38.73 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.5 p-10 -57.49 -45.06 85.34 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -178.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.8 OUTLIER -92.3 -10.53 38.03 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 122.106 -0.371 . . . . 0.0 111.569 179.434 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -98.12 -65.56 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.421 HD13 ' CD1' ' A' ' 50' ' ' TRP . 15.7 mm -80.48 150.16 4.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.708 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.415 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.18 172.29 12.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.726 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.474 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 24.9 t30 -112.71 110.57 20.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.373 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.8 mm -110.86 89.62 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.042 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.4 t70 68.71 39.19 2.04 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.908 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.75 0.66 90.29 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.978 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.1 m -110.53 136.74 49.19 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.933 0.397 . . . . 0.0 110.858 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.9 mt -77.08 116.31 17.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.544 0.687 . . . . 0.0 111.012 -178.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 31.4 mttt -135.25 161.92 34.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.015 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.432 ' CE2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -86.58 119.15 26.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.938 0.399 . . . . 0.0 111.19 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.419 ' O ' ' N ' ' A' ' 53' ' ' SER . 1.3 tp-100 -175.51 141.56 0.64 Allowed Pre-proline 0 C--N 1.331 -0.208 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.201 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.41 ' HD2' ' HG3' ' A' ' 51' ' ' GLN . 17.9 Cg_endo -61.47 76.17 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.265 1.977 . . . . 0.0 112.781 -179.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -166.89 135.41 2.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.665 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.08 108.99 15.99 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 25.4 p90 -49.51 -31.0 9.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.761 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.1 p -48.9 -16.77 0.14 Allowed 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -179.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -63.27 -29.53 70.84 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.15 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.474 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -128.89 1.86 5.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.286 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.7 m -112.79 147.93 35.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.244 0.545 . . . . 0.0 111.864 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 26.6 p90 -143.21 157.74 44.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.929 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 63.32 44.24 5.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.006 0.432 . . . . 0.0 110.485 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.5 m -69.08 137.14 53.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.466 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.87 152.89 42.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.596 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.468 HG13 ' HB2' ' A' ' 13' ' ' LEU . 33.8 mt -129.72 140.44 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-O 121.288 0.566 . . . . 0.0 111.805 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -136.19 108.55 7.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.791 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.93 -120.84 12.97 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.431 -0.89 . . . . 0.0 111.243 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.9 p -101.72 -3.67 27.78 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.1 t -101.88 139.23 23.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.977 0.418 . . . . 0.0 111.756 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.6 tp -100.93 125.12 47.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.332 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.6 m -115.6 123.49 48.56 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.2 t -151.92 153.83 34.91 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.41 -178.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.498 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 6.3 m -94.18 125.78 39.02 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 88.0 m -126.01 143.95 50.9 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -74.13 136.84 42.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.753 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 12.5 mtp-105 -92.15 144.21 25.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.724 0.297 . . . . 0.0 110.503 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.2 m -52.06 -27.12 12.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.749 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -83.56 2.39 37.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.617 0.246 . . . . 0.0 111.651 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.73 136.26 7.07 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.687 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.62 -169.6 12.99 Favored Glycine 0 C--N 1.318 -0.434 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 -178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -130.0 142.05 50.67 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.266 0.533 . . . . 0.0 111.123 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -153.79 128.74 9.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.203 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.498 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.7 t -93.12 134.69 35.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.607 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.3 p -122.9 158.35 30.56 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.443 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 14.9 m -122.71 145.64 48.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.902 0.382 . . . . 0.0 111.201 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.9 tt -145.33 143.72 21.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.812 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -97.1 116.29 29.04 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.745 179.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.41 ' O ' HG23 ' A' ' 90' ' ' VAL . 11.2 mt -97.62 -4.54 37.32 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.442 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 12.4 t-20 -44.92 -27.72 0.57 Allowed 'General case' 0 N--CA 1.466 0.342 0 O-C-N 122.155 -0.341 . . . . 0.0 111.874 -178.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.5 -41.28 21.95 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.446 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.5 m -72.67 -52.33 23.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.447 ' HB ' ' CD1' ' A' ' 4' ' ' PHE . 3.0 mp -83.13 147.37 5.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.103 0.477 . . . . 0.0 111.279 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.47 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 16.9 tt0 -139.92 167.09 22.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.14 -178.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -107.37 99.9 9.38 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.101 0.477 . . . . 0.0 110.805 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 58.8 t -98.53 97.48 6.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.007 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.7 t0 53.07 33.74 15.65 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.27 28.31 11.9 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.662 -0.78 . . . . 0.0 113.111 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.7 m -141.58 135.7 30.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.871 0.367 . . . . 0.0 111.279 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.47 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 63.0 mt -74.24 120.48 19.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.801 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 14.7 mttt -123.87 137.46 54.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.36 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.425 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 34.9 t80 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.791 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.2 p90 . . . . . 0 N--CA 1.463 0.199 0 CA-C-O 120.47 0.176 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.403 ' O ' HG13 ' A' ' 5' ' ' ILE . 5.8 tp -67.7 -11.74 14.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.365 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -76.74 -26.08 54.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.834 0.35 . . . . 0.0 110.552 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.0 p -118.37 -3.35 10.97 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.447 179.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 70.6 m -108.11 150.6 26.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.126 0.488 . . . . 0.0 111.402 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.401 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.4 ptm180 -131.87 172.47 12.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.506 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.406 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.8 p-10 49.45 56.97 7.02 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.062 0.458 . . . . 0.0 111.685 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 p -79.32 132.59 36.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.691 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -158.14 163.89 37.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.44 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.432 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.31 136.38 37.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.028 -179.624 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.81 143.59 47.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.163 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.07 -152.27 33.03 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 119.78 -1.2 . . . . 0.0 111.324 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.23 -36.74 19.23 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.442 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.1 p -140.9 34.96 1.76 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -178.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -115.22 148.8 38.66 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.073 0.463 . . . . 0.0 111.662 178.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.414 ' HB2' ' CD1' ' A' ' 64' ' ' ILE . 12.6 tp -122.97 124.9 44.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.346 179.231 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.06 144.15 46.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.3 172.48 16.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.117 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -116.51 133.38 56.09 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 177.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 17.2 m -130.73 136.77 49.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.027 0.441 . . . . 0.0 111.893 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.3 ptpt -66.74 137.9 56.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.481 -179.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 75.2 p -86.44 -175.78 5.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.879 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -61.64 -31.41 71.51 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 111.523 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.63 9.61 9.14 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 66.84 39.7 3.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.274 0.559 . . . . 0.0 111.381 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.417 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 74.8 mt-30 -118.82 136.65 53.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.664 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -93.77 124.82 38.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.898 0.38 . . . . 0.0 111.641 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.7 m -131.5 148.92 32.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.584 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 73.3 m -71.5 138.57 49.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.328 0.585 . . . . 0.0 112.044 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.6 t -143.94 161.25 39.19 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.18 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmmm? -139.87 154.61 47.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.396 0.617 . . . . 0.0 112.42 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.401 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.3 tp -137.78 125.08 29.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.048 -0.978 . . . . 0.0 108.925 179.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -88.97 120.61 30.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.728 0.299 . . . . 0.0 111.071 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.6 mp -88.98 -15.75 33.41 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.982 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.3 p-10 -57.82 -43.06 85.48 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -178.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.43 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 7.9 p-10 -92.77 -11.34 34.06 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 122.135 -0.353 . . . . 0.0 111.493 179.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.436 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 22.9 m-70 -97.61 -65.95 0.93 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.412 ' N ' ' CD1' ' A' ' 41' ' ' ILE . 2.1 mp -80.77 148.78 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.172 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -141.3 170.84 14.96 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.116 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.426 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 19.4 t30 -113.03 113.23 25.17 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.926 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.419 ' N ' ' CD1' ' A' ' 44' ' ' ILE . 2.4 mp -113.16 89.44 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.028 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 69.62 36.83 2.05 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.006 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.81 1.31 85.25 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.695 -0.764 . . . . 0.0 113.467 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 18.1 m -111.69 135.81 51.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 117.252 0.526 . . . . 0.0 111.255 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.3 mt -77.59 116.92 18.54 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.648 0.737 . . . . 0.0 111.599 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.4 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 9.8 mttm -137.82 162.74 33.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.921 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.463 ' CH2' ' CD1' ' A' ' 85' ' ' ILE . 11.6 m-90 -87.02 121.8 29.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.882 0.372 . . . . 0.0 111.184 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.426 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 35.2 tt0 -175.6 144.75 0.77 Allowed Pre-proline 0 N--CA 1.464 0.231 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.984 -179.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.43 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 29.9 Cg_endo -64.45 71.56 0.21 Allowed 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.084 1.856 . . . . 0.0 112.785 -179.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 51' ' ' GLN . 4.0 p -162.86 133.31 4.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.527 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -81.07 110.18 16.35 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -177.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.405 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 37.8 p90 -48.83 -29.38 4.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.402 178.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 74.8 p -48.65 -19.08 0.31 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.843 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -61.58 -30.49 70.71 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.34 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.426 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -127.96 -0.19 5.94 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.146 -0.222 . . . . 0.0 111.496 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -110.95 149.19 31.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.247 0.546 . . . . 0.0 112.292 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -143.02 157.43 44.55 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.102 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 64.03 46.52 3.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.003 0.43 . . . . 0.0 110.536 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 26.9 m -69.51 136.7 51.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.71 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.27 151.56 42.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.686 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.432 HG13 ' HB2' ' A' ' 13' ' ' LEU . 37.5 mt -130.6 139.04 52.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.354 0.597 . . . . 0.0 111.738 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -136.44 111.08 8.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.21 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.49 -121.26 17.14 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.161 -1.019 . . . . 0.0 110.934 -178.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.0 p -101.07 -3.88 28.44 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.7 t -101.67 138.43 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.9 tp -102.56 123.78 46.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.127 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.3 m -114.48 125.86 54.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 t -151.57 153.83 35.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.774 0.321 . . . . 0.0 111.494 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 8.5 m -93.91 126.18 38.96 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 82.7 m -126.03 142.74 51.39 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -75.58 140.1 42.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.799 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -92.82 143.51 26.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.686 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 37.3 m -51.94 -29.78 21.78 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.753 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.47 3.02 29.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.578 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.79 134.68 6.9 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.793 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 118.27 -174.77 15.43 Favored Glycine 0 C--N 1.318 -0.448 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -178.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -129.34 141.74 51.0 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 117.356 0.578 . . . . 0.0 110.845 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -153.95 130.31 10.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.424 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.1 t -92.51 134.49 34.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.48 -179.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.8 p -121.42 157.88 29.56 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.901 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -123.14 146.2 47.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.866 0.365 . . . . 0.0 111.301 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.463 ' CD1' ' CH2' ' A' ' 50' ' ' TRP . 15.7 tt -146.43 143.3 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.869 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -95.98 117.02 29.82 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.848 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.1 mt -96.1 -5.19 41.39 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -44.73 -27.63 0.52 Allowed 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.1 m -81.1 -39.67 25.31 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.464 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.1 m -73.49 -53.43 18.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -177.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.464 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.89 147.13 6.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.175 0.512 . . . . 0.0 112.042 -178.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.436 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 12.5 tt0 -138.96 166.17 25.18 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.923 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -107.58 99.75 9.22 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.193 0.52 . . . . 0.0 110.767 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.6 t -97.93 96.98 5.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.745 179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 22.3 t0 54.07 33.11 16.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.704 0.288 . . . . 0.0 111.56 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.56 28.45 12.67 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 120.723 -0.751 . . . . 0.0 113.223 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 68.0 p -140.33 135.94 32.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.898 0.38 . . . . 0.0 111.219 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.436 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 31.2 mt -74.21 119.35 18.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.067 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -124.29 138.25 54.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.447 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.436 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 32.5 t80 . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.01 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.421 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 19.7 p90 . . . . . 0 N--CA 1.466 0.336 0 CA-C-O 120.633 0.254 . . . . 0.0 111.444 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.414 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 3.8 tp -65.5 -14.43 16.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.707 0.289 . . . . 0.0 111.129 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 mp0 -76.33 -27.23 56.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.786 0.327 . . . . 0.0 110.528 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.3 p -119.23 19.1 12.92 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.181 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.9 m -131.35 154.86 48.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.136 0.494 . . . . 0.0 111.771 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -134.93 173.07 12.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.065 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 p30 49.32 57.12 6.83 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 p -79.54 130.55 35.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.63 178.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -156.43 163.26 39.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.64 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.417 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.98 136.6 38.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.187 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.88 143.17 48.08 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.462 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.3 -150.1 37.93 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.025 -1.083 . . . . 0.0 111.82 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.69 -37.1 18.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.454 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -143.23 35.64 1.35 Allowed 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -114.43 146.57 40.45 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.815 0.34 . . . . 0.0 111.484 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 tp -120.29 123.21 42.6 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.18 144.63 47.6 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.56 172.55 16.17 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.876 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -112.3 134.31 53.91 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 177.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.0 m -130.46 134.83 47.4 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.39 -0.524 . . . . 0.0 112.228 -178.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 6.3 ptpt -67.3 135.51 53.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.326 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 64.1 p -85.16 -179.33 6.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.27 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 45.8 mtt-85 -59.3 -29.69 67.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.559 -179.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.79 10.68 8.94 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 66.9 39.27 3.39 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.025 0.441 . . . . 0.0 112.005 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -121.44 132.63 54.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.419 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 46.8 m-85 -90.65 126.46 35.98 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.108 0.48 . . . . 0.0 111.922 -178.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.1 m -131.06 151.61 36.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.793 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 41.5 m -71.06 134.6 47.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.228 0.537 . . . . 0.0 111.948 -178.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.3 t -142.11 161.82 37.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.284 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.11 156.02 45.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.321 0.582 . . . . 0.0 112.394 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -138.46 125.0 25.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.113 -0.949 . . . . 0.0 108.774 179.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -87.17 115.92 24.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.649 0.261 . . . . 0.0 111.199 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.1 mp -87.17 -16.29 35.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.391 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.86 -45.84 74.62 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.64 0.257 . . . . 0.0 111.467 -178.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.47 -10.4 37.96 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.401 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 28.6 m-70 -97.86 -65.9 0.93 Allowed 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.423 ' N ' ' CD1' ' A' ' 41' ' ' ILE . 1.9 mp -80.03 149.29 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.295 178.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -141.36 172.68 12.35 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.933 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.438 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 20.0 t30 -112.72 112.27 23.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.219 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.1 mp -111.85 93.46 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-O 120.865 0.364 . . . . 0.0 110.805 179.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 38.3 t0 64.78 39.64 6.07 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.206 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.28 1.83 90.38 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.562 -0.828 . . . . 0.0 113.123 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 20.9 m -112.46 137.13 51.11 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 117.187 0.494 . . . . 0.0 111.004 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 66.3 mt -77.72 118.55 20.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.433 0.635 . . . . 0.0 112.326 -177.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 37.5 mttt -139.65 163.34 32.84 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.101 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.433 ' CE2' HG12 ' A' ' 90' ' ' VAL . 9.8 m-90 -87.1 121.71 29.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 111.637 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.451 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 38.5 tt0 -175.26 145.3 0.85 Allowed Pre-proline 0 N--CA 1.466 0.332 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.909 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.451 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 37.1 Cg_endo -65.25 71.26 0.28 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.267 1.978 . . . . 0.0 112.797 -179.06 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.1 p -162.48 133.19 4.84 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.47 179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.16 112.4 18.47 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.247 0.546 . . . . 0.0 112.457 -177.634 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.45 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 49.3 p90 -51.56 -30.39 20.56 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.952 178.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.7 p -50.87 -17.36 0.55 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -62.07 -29.46 70.32 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.042 -0.263 . . . . 0.0 110.634 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.438 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -129.04 0.66 5.25 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.664 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.5 m -112.16 147.96 35.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.112 0.482 . . . . 0.0 112.06 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -141.71 157.39 45.11 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.24 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 63.49 44.89 5.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.105 0.479 . . . . 0.0 110.456 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 70.7 m -68.51 137.0 54.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.663 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.62 152.6 41.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.822 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.476 HD12 HG22 ' A' ' 64' ' ' ILE . 58.3 mt -130.94 140.74 47.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.337 0.589 . . . . 0.0 111.628 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -137.78 109.48 7.07 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.652 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.89 -122.43 13.49 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.675 -178.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.4 p -101.78 -2.8 29.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 117.012 0.406 . . . . 0.0 112.085 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 t -102.54 137.3 31.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-O 120.957 0.408 . . . . 0.0 111.752 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.5 tp -100.89 124.08 46.04 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.349 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.1 m -114.24 125.5 53.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.111 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.7 t -151.58 153.59 34.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.794 0.331 . . . . 0.0 111.722 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.1 m -94.42 126.02 39.43 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.3 m -127.7 145.32 50.94 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -178.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -74.86 138.03 42.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.477 177.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 56.4 mtp180 -91.09 142.98 27.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.555 0.217 . . . . 0.0 110.532 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 62.7 m -52.1 -25.13 8.06 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.694 0.283 . . . . 0.0 111.554 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -84.13 1.57 43.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.387 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.42 135.83 7.21 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.839 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.06 -167.34 12.3 Favored Glycine 0 C--N 1.32 -0.335 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -131.99 141.49 49.29 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 117.329 0.564 . . . . 0.0 111.594 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -153.99 129.89 10.19 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.454 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.6 t -92.13 135.18 34.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.737 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.2 p -121.88 158.33 29.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.203 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 4.5 p -121.87 145.65 47.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.797 0.332 . . . . 0.0 111.104 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.416 HD12 ' CZ3' ' A' ' 50' ' ' TRP . 13.2 tt -144.42 143.32 23.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.647 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -97.15 117.6 31.7 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.781 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.8 mt -99.4 -4.61 31.16 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -178.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.414 ' ND2' ' CG2' ' A' ' 5' ' ' ILE . 10.7 t-20 -44.82 -29.1 0.73 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -178.358 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.7 m -81.32 -41.67 21.73 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.433 HG12 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -70.58 -52.76 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -177.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.432 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.8 mp -83.33 147.59 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.913 0.387 . . . . 0.0 111.543 -179.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.405 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 31.3 tt0 -138.51 165.57 26.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.22 -179.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -105.96 99.53 9.11 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 121.183 0.516 . . . . 0.0 110.766 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 47.8 t -97.54 97.12 5.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.538 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.0 t0 53.19 33.29 14.95 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.763 0.282 . . . . 0.0 111.763 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.5 28.63 11.13 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.752 -0.737 . . . . 0.0 113.253 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.28 135.24 30.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.931 0.396 . . . . 0.0 110.971 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.405 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 79.2 mt -74.01 119.86 18.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.803 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -123.02 131.03 53.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.417 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.422 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 14.2 t80 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.147 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.413 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 13.6 p90 . . . . . 0 N--CA 1.464 0.239 0 CA-C-O 120.673 0.273 . . . . 0.0 111.296 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.402 ' CB ' ' HB3' ' A' ' 67' ' ' SER . 8.0 tp -63.04 -20.04 24.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.449 -179.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -77.64 -25.51 49.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.784 0.326 . . . . 0.0 110.552 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.0 p -118.4 16.66 13.87 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.849 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.3 m -134.13 155.7 49.61 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.99 0.424 . . . . 0.0 111.37 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.41 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.9 ptt180 -132.29 172.9 11.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.945 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.438 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.2 p-10 49.52 57.46 6.48 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.239 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 19.3 p -78.94 132.15 36.62 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -157.66 163.85 37.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.616 -179.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.444 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.5 OUTLIER -97.21 136.52 37.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.037 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.9 143.63 47.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.134 179.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.15 -152.19 33.51 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 119.849 -1.167 . . . . 0.0 111.534 -178.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.47 -37.01 18.71 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -178.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -141.25 35.65 1.7 Allowed 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -115.69 146.74 41.59 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.156 0.503 . . . . 0.0 111.833 178.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.415 ' HB2' HD12 ' A' ' 37' ' ' LEU . 13.3 tp -119.09 124.13 46.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.321 179.023 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.85 143.19 47.12 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.09 172.24 17.15 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.33 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -112.17 133.65 54.18 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 83.7 m -130.97 134.56 46.84 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.2 ptpt -67.03 136.02 54.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.241 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 75.8 p -85.77 -177.81 6.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.272 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.8 mmp_? -61.26 -29.32 69.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.87 0.366 . . . . 0.0 110.794 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.44 8.72 8.71 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 66.56 36.35 4.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.262 0.553 . . . . 0.0 111.037 -178.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 25.2 mt-30 -118.53 136.93 53.55 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.862 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -93.06 124.76 37.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.909 0.385 . . . . 0.0 111.702 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.2 m -129.98 149.72 33.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.619 179.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.2 p -71.02 135.06 47.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.185 0.517 . . . . 0.0 111.88 -178.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.9 t -142.51 161.42 38.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.253 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -142.35 156.72 45.26 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.394 0.616 . . . . 0.0 112.371 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.416 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.1 tp -139.52 125.18 21.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.087 179.335 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -87.66 120.35 28.89 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.663 0.268 . . . . 0.0 111.289 -178.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.415 HD12 ' HB2' ' A' ' 19' ' ' LEU . 4.2 mp -88.35 -15.29 36.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.825 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.428 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.6 p-10 -57.51 -43.36 84.19 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 5.1 p30 -92.48 -10.58 37.31 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 122.077 -0.389 . . . . 0.0 111.848 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -99.51 -63.33 1.13 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.462 ' N ' ' CD1' ' A' ' 41' ' ' ILE . 1.5 mp -79.64 147.16 6.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.791 178.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.406 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -140.41 170.05 16.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.654 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.446 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 27.1 t30 -113.21 111.79 22.66 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.292 -179.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.416 ' CD1' ' HB2' ' A' ' 49' ' ' LYS . 2.3 mp -112.37 89.56 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.529 179.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.3 t70 68.52 38.81 2.27 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.042 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.95 0.83 90.52 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.624 -0.798 . . . . 0.0 113.426 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.8 m -108.72 135.33 50.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 117.334 0.567 . . . . 0.0 110.507 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.0 mt -77.49 117.0 18.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.65 0.738 . . . . 0.0 111.693 -177.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.416 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 10.3 mttm -138.3 163.26 32.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.577 179.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.455 ' O ' ' CG ' ' A' ' 51' ' ' GLN . 9.1 m-90 -88.03 122.4 31.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.856 0.36 . . . . 0.0 111.791 -179.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.455 ' CG ' ' O ' ' A' ' 50' ' ' TRP . 26.4 mt-30 -171.16 149.81 2.73 Favored Pre-proline 0 N--CA 1.47 0.53 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.65 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -69.74 66.48 1.76 Allowed 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 121.831 1.687 . . . . 0.0 112.035 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.2 p -157.7 134.57 9.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.967 -1.015 . . . . 0.0 108.732 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -81.54 109.88 16.41 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -178.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.414 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 38.4 p90 -48.45 -29.73 4.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.576 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.2 p -48.36 -19.36 0.3 Allowed 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -62.46 -24.82 67.65 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.499 -178.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.446 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -133.3 2.4 3.55 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.4 m -112.58 148.53 34.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.13 0.49 . . . . 0.0 112.318 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -139.97 155.51 47.09 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.942 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 64.19 49.63 2.59 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.953 0.406 . . . . 0.0 111.103 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 44.9 m -71.34 135.2 47.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.788 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.85 151.93 41.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.507 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.444 HG13 ' HB2' ' A' ' 13' ' ' LEU . 38.1 mt -129.94 140.49 48.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.27 0.557 . . . . 0.0 111.848 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -136.6 110.63 8.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.507 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.32 -121.87 16.71 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.224 -0.989 . . . . 0.0 110.887 -178.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.402 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.6 p -101.54 -3.21 28.9 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.0 t -102.86 140.7 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 120.985 0.421 . . . . 0.0 111.814 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.2 tp -102.85 126.79 50.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.498 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.6 m -115.21 124.23 50.87 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 t -151.78 153.64 34.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.742 0.306 . . . . 0.0 111.288 -178.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.48 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.8 m -94.42 125.7 39.23 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 75.2 m -126.16 143.41 51.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.435 0.636 . . . . 0.0 112.514 -178.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -75.7 139.53 41.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.89 178.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 47.8 mtp85 -93.55 144.63 25.19 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.754 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.6 m -51.85 -28.39 15.76 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.786 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -83.15 1.98 37.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.497 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.2 136.69 7.48 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.778 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.7 -170.78 13.51 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -131.22 141.85 50.09 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.238 0.519 . . . . 0.0 111.121 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 41.0 t30 -154.14 129.49 9.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.347 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.48 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.2 t -92.72 134.78 34.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.714 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.4 p -121.83 158.48 28.82 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.546 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 46.0 m -121.9 143.96 49.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.359 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.6 tt -145.11 143.08 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.843 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -96.97 116.26 28.88 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.035 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.8 mt -97.44 -6.83 33.04 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.413 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 7.4 t-20 -45.1 -27.53 0.6 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -178.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 61.7 m -81.88 -41.15 21.37 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.455 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 2.9 m -71.65 -51.18 34.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -178.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.455 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.8 mp -82.8 147.51 5.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.965 0.412 . . . . 0.0 111.182 -179.172 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -138.38 166.58 23.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.04 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -107.64 99.77 9.23 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.074 0.464 . . . . 0.0 110.629 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.5 t -98.36 97.11 5.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.868 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 34.2 t0 52.83 33.2 13.75 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.24 28.72 11.2 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.581 -0.819 . . . . 0.0 113.371 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 54.1 p -141.1 134.96 30.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.925 0.393 . . . . 0.0 111.289 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.416 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 41.1 mt -73.31 119.16 17.16 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.681 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.3 mttm -125.21 139.32 53.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.639 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 34.7 t80 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.59 179.769 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.446 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 15.6 p90 . . . . . 0 N--CA 1.466 0.327 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.413 ' CB ' ' HB3' ' A' ' 67' ' ' SER . 8.0 tp -61.77 -20.76 24.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.663 0.268 . . . . 0.0 111.618 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -75.92 -23.92 55.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.198 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.0 p -118.17 8.43 12.36 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 m -125.39 154.86 41.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.077 0.465 . . . . 0.0 111.226 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.2 173.18 11.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.814 -179.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.416 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.8 p-10 49.18 58.13 5.72 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.005 0.431 . . . . 0.0 112.152 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.9 p -79.57 131.98 36.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.784 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -157.45 163.72 38.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.448 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.468 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.37 136.72 37.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.841 -179.65 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.85 143.9 47.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.435 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.35 -151.01 36.49 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 119.927 -1.13 . . . . 0.0 111.522 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.28 -37.2 18.8 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.455 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.18 35.86 1.53 Allowed 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -114.36 149.99 35.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.02 0.438 . . . . 0.0 111.806 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.3 tp -123.56 124.22 42.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.546 179.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.42 144.31 47.01 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.865 0.364 . . . . 0.0 110.196 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.38 172.24 16.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.373 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -111.52 134.12 53.31 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 64.2 m -131.01 132.32 44.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.141 0.496 . . . . 0.0 112.103 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.423 ' HB3' ' CE2' ' A' ' 30' ' ' PHE . 1.9 ptpt -66.41 136.93 56.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.219 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 82.6 p -85.86 -178.47 6.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.481 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 29.9 mtt180 -60.82 -30.06 69.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.766 0.317 . . . . 0.0 111.03 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.78 9.06 8.6 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 66.96 37.32 3.93 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.145 0.497 . . . . 0.0 111.635 -178.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -118.5 135.46 54.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.009 177.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.423 ' CE2' ' HB3' ' A' ' 24' ' ' LYS . 77.5 m-85 -92.34 124.61 36.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.994 0.426 . . . . 0.0 111.879 -178.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.6 m -129.88 148.24 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.295 179.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.4 t -70.14 136.49 50.18 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.305 0.574 . . . . 0.0 111.814 -178.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.7 t -143.14 161.53 37.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.994 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.3 ttpt -142.6 157.12 45.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.289 0.566 . . . . 0.0 111.901 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -138.6 127.13 29.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.29 179.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -87.68 117.02 26.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.629 0.252 . . . . 0.0 111.511 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.2 mp -86.11 -16.18 38.8 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.61 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -55.08 -48.03 74.09 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.886 -178.625 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.444 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.6 OUTLIER -92.08 -10.06 40.42 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 122.26 -0.275 . . . . 0.0 111.508 179.536 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.415 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 23.4 m-70 -96.5 -69.54 0.75 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.433 ' N ' ' CD1' ' A' ' 41' ' ' ILE . 1.8 mp -79.34 151.36 4.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.137 178.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.404 ' CB ' ' OG ' ' A' ' 53' ' ' SER . . . -141.74 172.38 12.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.956 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.487 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 23.2 t30 -112.82 113.1 25.04 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.971 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.426 ' CD1' ' HB2' ' A' ' 49' ' ' LYS . 2.6 mp -113.25 89.95 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.818 0.342 . . . . 0.0 111.327 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 39.6 t0 69.32 38.77 1.78 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.587 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.15 3.37 88.97 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 120.598 -0.81 . . . . 0.0 113.061 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 52.1 m -115.89 137.4 52.14 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.944 0.402 . . . . 0.0 111.124 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.9 mt -77.45 116.64 18.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.569 0.699 . . . . 0.0 111.925 -177.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.426 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 38.3 mttt -137.22 162.56 33.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.701 -1.136 . . . . 0.0 109.527 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.448 ' CE2' HG13 ' A' ' 90' ' ' VAL . 6.1 m-90 -87.67 124.1 33.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.103 0.478 . . . . 0.0 112.062 -179.063 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.421 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 12.6 tt0 -176.33 149.72 0.97 Allowed Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.179 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.444 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 12.3 Cg_exo -67.94 66.15 0.93 Allowed 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.27 1.98 . . . . 0.0 112.485 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.404 ' OG ' ' CB ' ' A' ' 42' ' ' ALA . 3.1 p -155.92 135.44 12.44 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.726 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.435 ' ND2' ' N ' ' A' ' 54' ' ' ASN . 0.0 OUTLIER -82.62 106.6 14.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.216 0.532 . . . . 0.0 112.313 -177.701 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.455 ' CZ ' ' CB ' ' A' ' 17' ' ' SER . 33.8 p90 -47.78 -30.18 3.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.532 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.6 p -49.35 -18.03 0.33 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.893 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -64.78 -26.93 68.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.569 0.223 . . . . 0.0 111.6 -178.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.487 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.3 p -128.68 -3.42 5.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.558 0.218 . . . . 0.0 111.485 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 72' ' ' THR . 4.8 m -109.2 148.96 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.207 0.527 . . . . 0.0 111.894 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.4 p90 -142.23 157.35 44.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.946 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.6 m-20 63.21 45.44 5.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.043 0.449 . . . . 0.0 110.75 -179.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.4 m -69.25 137.08 52.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.604 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.38 151.17 43.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.489 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.468 HG13 ' HB2' ' A' ' 13' ' ' LEU . 24.3 mt -129.29 140.27 49.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.297 0.57 . . . . 0.0 111.823 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -136.77 108.92 7.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.238 -0.892 . . . . 0.0 108.98 179.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.75 -120.53 11.13 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.264 -0.97 . . . . 0.0 111.077 -178.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.413 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 20.6 p -103.33 -0.86 29.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.808 0.304 . . . . 0.0 111.514 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.7 t -103.61 139.11 25.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-O 120.934 0.397 . . . . 0.0 111.709 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 11.6 tp -103.94 124.9 49.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.345 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.3 m -114.86 125.22 53.41 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -152.13 153.88 34.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.625 0.25 . . . . 0.0 111.438 -178.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.4 m -94.26 125.8 39.11 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 96.1 m -123.87 142.38 51.17 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -73.7 137.31 43.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.873 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 18.7 mtm180 -91.45 142.39 27.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.694 0.283 . . . . 0.0 110.322 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.9 m -52.0 -28.99 18.87 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -83.73 3.82 31.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.656 0.265 . . . . 0.0 111.641 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.92 135.65 7.37 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.905 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.35 -171.95 14.0 Favored Glycine 0 C--N 1.319 -0.378 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -178.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -131.28 144.02 50.98 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 117.308 0.554 . . . . 0.0 111.263 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -154.2 129.53 9.77 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.302 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.6 t -92.54 134.88 34.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.74 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 81.3 p -122.35 158.07 30.43 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.317 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.9 m -122.9 144.06 49.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.871 0.367 . . . . 0.0 111.148 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.426 HD11 ' CZ2' ' A' ' 50' ' ' TRP . 13.5 tt -145.65 143.99 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.895 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -97.58 116.3 29.52 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.798 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.422 ' O ' HG21 ' A' ' 90' ' ' VAL . 6.0 mt -98.31 -6.64 30.53 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.446 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 6.8 t-20 -44.98 -27.98 0.61 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -178.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.0 t -81.93 -39.81 23.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.453 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.2 m -72.49 -52.08 25.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.453 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.53 147.64 5.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.007 0.432 . . . . 0.0 110.86 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 99' ' ' LYS . 10.9 tt0 -139.31 166.71 23.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.207 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -107.5 99.94 9.4 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.101 0.477 . . . . 0.0 110.662 -179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.7 t -100.38 97.96 6.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.04 179.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.1 t0 53.53 32.03 13.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.656 0.265 . . . . 0.0 111.672 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.93 28.55 10.85 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.619 -0.801 . . . . 0.0 113.369 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 36.1 t -140.93 134.45 29.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.902 0.382 . . . . 0.0 111.193 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.403 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 42.9 mt -73.01 119.51 17.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.75 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.413 ' O ' ' N ' ' A' ' 92' ' ' GLU . 26.2 mmtt -122.99 132.17 54.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.072 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.415 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 13.2 t80 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.61 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.461 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 18.2 p90 . . . . . 0 N--CA 1.466 0.327 0 CA-C-O 120.527 0.203 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.431 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 8.3 tp -62.22 -22.31 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.778 0.323 . . . . 0.0 111.239 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -73.06 -24.43 60.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.832 0.349 . . . . 0.0 110.852 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.7 p -119.19 17.37 13.17 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.871 0.367 . . . . 0.0 111.723 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.9 m -133.21 155.28 49.63 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.0 0.428 . . . . 0.0 110.919 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.0 ptt85 -135.64 172.93 12.3 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.403 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.428 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.1 p-10 48.29 57.93 5.68 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.736 -0.666 . . . . 0.0 112.445 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.0 p -78.99 135.55 36.94 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.05 178.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -158.91 163.52 36.48 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.039 0.447 . . . . 0.0 111.678 -179.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.419 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.61 136.5 37.91 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.807 179.897 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.9 143.14 48.11 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.407 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.61 -149.14 33.4 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 119.944 -1.122 . . . . 0.0 111.887 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -87.3 -37.77 16.87 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -177.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.8 p -141.62 36.36 1.64 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -115.93 149.64 38.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.257 0.551 . . . . 0.0 111.976 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.419 ' N ' ' CD1' ' A' ' 37' ' ' LEU . 14.0 tp -123.49 123.79 41.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.768 178.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.91 142.68 47.07 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.64 172.78 15.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.523 -178.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -113.36 134.12 54.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 83.9 m -131.19 132.84 44.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.924 0.392 . . . . 0.0 111.82 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 5.2 ptpt -64.63 138.9 58.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.228 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 75.5 p -86.97 -176.87 5.9 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.506 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -61.02 -30.65 70.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.884 0.373 . . . . 0.0 111.277 -179.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.13 10.48 8.13 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -178.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 67.43 37.72 3.41 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.165 0.507 . . . . 0.0 111.216 -178.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -119.06 133.58 55.72 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.363 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.411 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 34.3 m-85 -91.3 125.42 36.06 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.115 0.483 . . . . 0.0 112.101 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.9 m -128.65 151.64 35.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.934 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.5 p -71.29 132.89 45.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.263 0.554 . . . . 0.0 111.784 -178.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.0 t -142.09 162.35 35.71 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.183 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.11 154.7 43.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.378 0.608 . . . . 0.0 111.85 -179.008 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.1 tp -135.76 125.78 41.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 179.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -88.02 117.49 26.93 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.952 -178.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.419 ' CD1' ' N ' ' A' ' 19' ' ' LEU . 3.4 mp -87.87 -15.87 35.53 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.0 p-10 -57.72 -44.86 86.28 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -177.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.444 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 3.5 m-20 -91.86 -9.97 41.42 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 122.047 -0.408 . . . . 0.0 111.247 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.437 ' CE1' ' HB2' ' A' ' 100' ' ' TYR . 14.3 m-70 -93.28 -63.55 1.2 Allowed 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.4 ' CD1' HD22 ' A' ' 87' ' ' LEU . 34.9 mt -83.05 154.03 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.965 178.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.403 ' CB ' ' HB2' ' A' ' 51' ' ' GLN . . . -142.0 171.89 13.44 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.257 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.407 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 25.8 t30 -112.6 111.36 22.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.618 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.449 ' N ' ' CD1' ' A' ' 44' ' ' ILE . 1.9 mp -111.7 88.56 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-O 121.05 0.452 . . . . 0.0 110.736 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 52.3 t0 67.91 39.39 2.58 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.16 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.1 2.68 90.56 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.741 -0.743 . . . . 0.0 113.348 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.6 m -109.92 136.38 49.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.199 0.499 . . . . 0.0 111.264 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 23.6 mt -77.1 116.29 17.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.701 0.762 . . . . 0.0 111.465 -178.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.3 mttt -139.43 163.52 32.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.684 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.44 ' CZ2' HD11 ' A' ' 85' ' ' ILE . 9.5 m-90 -88.64 127.52 35.57 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.403 ' HB2' ' CB ' ' A' ' 42' ' ' ALA . 0.6 OUTLIER -174.46 151.96 1.65 Allowed Pre-proline 0 N--CA 1.469 0.519 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.539 -179.772 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.444 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 63.7 Cg_endo -74.12 66.17 5.2 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 121.945 1.763 . . . . 0.0 112.485 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -162.36 133.2 4.94 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.7 -1.136 . . . . 0.0 107.969 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.1 114.22 17.86 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -177.219 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.412 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 39.5 p90 -48.95 -29.24 4.56 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.386 177.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.6 p -49.83 -18.89 0.56 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.356 -178.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -60.8 -26.53 67.37 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.639 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.407 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.5 p -131.16 1.65 4.23 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.1 m -113.76 147.35 38.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.298 0.57 . . . . 0.0 112.481 -178.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.3 p90 -141.24 157.91 44.61 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.073 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 64.99 45.71 3.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.997 0.427 . . . . 0.0 111.39 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 46.4 m -67.82 135.51 52.69 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.639 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.56 151.8 41.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.561 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.419 HG13 ' HB2' ' A' ' 13' ' ' LEU . 48.3 mt -130.15 139.75 50.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.315 0.579 . . . . 0.0 111.907 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -134.05 109.09 8.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.932 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 65.59 -119.37 13.77 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.215 -0.993 . . . . 0.0 111.205 -178.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 19.4 p -101.53 -5.59 24.97 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.6 t -101.03 138.27 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 120.872 0.368 . . . . 0.0 111.583 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.7 tp -101.12 125.7 47.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.138 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.0 m -115.07 125.55 53.66 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.8 t -151.4 153.16 34.17 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.331 -178.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.4 m -93.91 126.0 38.86 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 89.7 m -126.58 144.6 50.84 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -73.36 134.99 44.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.48 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.0 mtp85 -92.09 142.88 27.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.647 0.26 . . . . 0.0 110.654 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 33.1 m -51.54 -28.2 13.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.67 -178.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -82.11 1.87 34.01 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.538 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.81 133.72 6.53 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.997 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.3 -167.48 12.5 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -130.89 142.15 50.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.797 0.298 . . . . 0.0 111.178 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -154.74 130.79 10.23 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.685 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -93.82 134.46 36.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.102 0.477 . . . . 0.0 111.574 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.3 p -120.67 158.93 26.36 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.636 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.3 p -123.92 145.85 48.86 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.859 0.361 . . . . 0.0 111.191 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.44 HD11 ' CZ2' ' A' ' 50' ' ' TRP . 15.2 tt -144.89 143.33 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.637 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -96.92 116.93 30.05 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.419 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.409 ' O ' HG22 ' A' ' 90' ' ' VAL . 6.9 mt -95.83 -4.71 43.28 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -178.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.461 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 11.9 t-20 -43.76 -29.31 0.51 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.289 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.3 m -81.77 -40.43 22.65 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.43 HG12 ' CZ2' ' A' ' 50' ' ' TRP . 3.5 m -70.86 -53.17 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.422 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -83.13 145.29 8.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.281 0.562 . . . . 0.0 112.052 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -135.75 165.49 25.47 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.942 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -107.18 99.84 9.35 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.971 0.415 . . . . 0.0 111.141 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 25.7 t -99.53 99.34 8.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.798 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.9 t0 53.08 32.09 12.39 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.773 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.15 28.83 10.26 Favored Glycine 0 C--N 1.329 0.144 0 C-N-CA 120.579 -0.82 . . . . 0.0 113.149 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 t -141.01 135.95 31.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.864 0.364 . . . . 0.0 111.029 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 67.5 mt -74.6 121.3 21.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.0 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -127.24 137.21 52.83 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-O 121.065 0.46 . . . . 0.0 112.202 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.437 ' HB2' ' CE1' ' A' ' 40' ' ' HIS . 35.8 t80 . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.686 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.437 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 23.1 p90 . . . . . 0 N--CA 1.464 0.266 0 CA-C-O 120.48 0.181 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.406 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 7.3 tp -65.5 -15.68 19.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.696 0.284 . . . . 0.0 111.334 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -75.4 -25.24 57.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.764 0.316 . . . . 0.0 110.659 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.9 p -118.8 18.19 13.36 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.465 179.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.2 m -133.41 154.76 50.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.947 0.403 . . . . 0.0 111.441 -179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -133.69 172.74 12.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.174 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 49.0 57.77 6.09 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.209 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.2 p -79.39 133.11 36.57 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -157.76 163.77 37.75 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.399 -178.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.423 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.35 135.4 39.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.574 179.748 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -118.9 143.54 46.94 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.195 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.69 -151.49 33.06 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 119.891 -1.147 . . . . 0.0 111.465 -178.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.64 -37.19 18.27 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.8 35.24 1.78 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -115.91 146.96 41.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.017 0.437 . . . . 0.0 111.775 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.2 tp -119.75 124.91 47.35 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.89 143.58 47.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.922 0.392 . . . . 0.0 110.486 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.35 172.46 16.53 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.164 -178.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.33 133.88 54.18 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 177.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.6 m -130.54 133.16 46.01 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.255 0.55 . . . . 0.0 111.935 -178.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 4.5 ptpt -66.45 136.05 55.15 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.273 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 69.2 p -85.29 -177.59 6.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.577 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.0 mmt85 -60.8 -29.7 69.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.681 0.276 . . . . 0.0 111.263 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.11 9.32 10.67 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 66.68 37.84 4.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.159 0.504 . . . . 0.0 111.528 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.407 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 67.6 mt-30 -117.22 135.83 53.51 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -92.42 125.16 36.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 111.836 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 m -130.37 151.19 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.819 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.8 m -72.1 134.19 45.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.194 0.521 . . . . 0.0 111.558 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.2 t -142.68 161.45 38.05 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.188 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -142.82 156.34 44.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.473 0.654 . . . . 0.0 112.276 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.408 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.0 OUTLIER -136.47 124.42 34.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.468 179.127 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -87.75 119.55 28.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.717 0.294 . . . . 0.0 110.752 -178.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.414 ' O ' ' N ' ' A' ' 41' ' ' ILE . 4.1 mp -88.84 -14.86 35.94 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.457 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 6.4 p-10 -56.04 -46.54 78.83 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.457 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.1 p30 -92.36 -10.0 39.78 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 122.081 -0.387 . . . . 0.0 111.564 179.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -96.33 -64.6 1.03 Allowed 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.423 ' CD1' ' NE1' ' A' ' 50' ' ' TRP . 33.0 mm -80.52 147.54 6.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.541 178.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.437 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.18 171.55 13.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.772 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.451 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 22.7 t30 -113.18 112.53 23.94 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.033 -179.321 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.403 ' N ' ' CD1' ' A' ' 44' ' ' ILE . 1.9 mp -110.61 89.4 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.726 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 52.7 t0 67.55 39.39 2.84 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.402 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.74 0.75 87.63 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.674 -0.774 . . . . 0.0 113.263 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.1 m -112.63 135.28 53.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.15 0.475 . . . . 0.0 110.632 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.1 mt -77.34 118.9 20.27 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.553 0.692 . . . . 0.0 111.305 -178.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.9 mttt -136.82 162.75 32.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.851 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.449 ' CE2' HG12 ' A' ' 90' ' ' VAL . 9.2 m-90 -85.54 119.83 26.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.941 0.4 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -173.77 148.31 1.43 Allowed Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.28 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -67.22 65.53 0.67 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.317 2.011 . . . . 0.0 112.833 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.437 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.2 p -157.63 134.35 9.91 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.823 178.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.434 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.0 109.28 15.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.125 0.488 . . . . 0.0 112.059 -178.034 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.413 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 32.7 p90 -48.45 -29.09 3.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.532 178.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.8 p -48.65 -19.34 0.34 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.687 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -62.36 -25.25 67.81 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 121.066 -0.254 . . . . 0.0 111.271 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.451 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -133.82 3.4 3.49 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.2 m -115.36 149.49 37.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.269 0.557 . . . . 0.0 112.34 -178.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -143.03 157.81 44.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.782 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 64.28 46.19 3.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.903 0.383 . . . . 0.0 110.512 -178.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 72.4 m -70.12 135.33 49.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.689 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.63 152.04 42.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.768 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.423 HG13 ' HB2' ' A' ' 13' ' ' LEU . 22.0 mt -129.71 140.18 49.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.305 0.574 . . . . 0.0 111.762 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -135.6 108.92 7.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.044 179.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.94 -120.99 13.18 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.081 -178.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.8 p -102.11 -3.93 26.73 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.5 t -101.83 139.95 21.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-O 120.902 0.382 . . . . 0.0 111.561 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.6 tp -104.08 128.88 51.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.854 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.5 m -118.09 127.11 53.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.417 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -151.93 153.34 33.92 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.276 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.478 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.7 m -94.59 125.83 39.49 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 78.8 m -126.18 144.56 50.72 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.62 137.31 42.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.645 178.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.0 mtp85 -92.56 144.64 25.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.706 0.289 . . . . 0.0 110.591 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.3 m -51.87 -28.06 14.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.7 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -83.43 1.95 39.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.667 0.27 . . . . 0.0 111.554 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.29 136.97 7.17 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.655 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.39 -171.27 13.69 Favored Glycine 0 C--N 1.32 -0.352 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -130.06 141.12 50.75 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.296 0.548 . . . . 0.0 111.212 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -153.93 130.67 10.8 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.232 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.478 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.2 t -93.57 134.95 35.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.681 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 92.3 p -123.24 158.33 31.12 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.298 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.1 p -123.42 146.47 47.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.257 -179.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.44 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 14.1 tt -145.41 143.1 22.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.584 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -95.79 119.13 33.73 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.971 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.9 mt -99.26 -5.65 29.46 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.437 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 12.4 t-20 -44.75 -28.2 0.6 Allowed 'General case' 0 N--CA 1.467 0.404 0 O-C-N 122.081 -0.387 . . . . 0.0 111.982 -178.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.0 t -82.35 -40.06 21.91 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.461 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.2 m -72.4 -53.0 20.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -178.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.461 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -83.41 147.44 5.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.017 0.437 . . . . 0.0 111.339 -179.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 99' ' ' LYS . 11.9 tt0 -138.33 165.86 25.68 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.974 -178.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -108.45 100.13 9.44 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.156 0.503 . . . . 0.0 110.586 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.9 t -98.97 98.59 7.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.072 179.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.2 t0 53.06 33.74 15.62 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 111.752 0.278 . . . . 0.0 111.752 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.46 28.56 12.59 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.344 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.8 m -140.68 136.07 32.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.861 0.362 . . . . 0.0 111.296 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.408 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 59.3 mt -74.39 119.25 18.34 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.5 mmtt -125.17 138.23 54.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.374 -179.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.447 ' CE1' ' HB ' ' A' ' 90' ' ' VAL . 89.0 t80 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.344 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.432 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 30.1 p90 . . . . . 0 N--CA 1.463 0.182 0 N-CA-C 111.648 0.24 . . . . 0.0 111.648 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 7.5 tp -63.49 -17.29 19.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.912 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.76 -26.82 57.75 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.943 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.9 p -118.96 20.8 12.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.283 179.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 65.7 m -136.34 154.74 50.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.033 0.444 . . . . 0.0 111.407 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 ptm85 -133.78 173.16 11.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.192 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 48.85 57.82 5.99 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.072 -0.513 . . . . 0.0 112.106 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.1 p -79.06 131.96 36.44 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 178.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -157.56 164.02 37.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.892 0.377 . . . . 0.0 111.743 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.429 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.9 OUTLIER -97.41 136.01 38.47 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.056 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.11 143.84 47.95 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.63 -151.78 32.21 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 119.797 -1.192 . . . . 0.0 111.608 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.0 -37.5 18.9 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -178.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -142.12 36.56 1.55 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -115.51 147.29 40.83 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.985 0.421 . . . . 0.0 111.704 178.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.403 ' HB2' HD13 ' A' ' 37' ' ' LEU . 17.0 tp -120.55 123.66 43.42 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.55 143.85 46.47 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.4 172.74 15.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.522 -178.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -112.34 133.55 54.38 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 177.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 84.5 m -130.8 133.97 46.44 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 8.5 ptpt -66.51 134.86 53.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.011 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 70.8 p -84.05 -176.2 6.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.504 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.25 -30.5 70.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.753 0.311 . . . . 0.0 111.036 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.64 10.04 8.28 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 66.89 37.77 3.9 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.151 0.5 . . . . 0.0 111.778 -179.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.418 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 66.6 mt-30 -120.32 135.19 55.1 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.015 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.418 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 30.4 m-85 -92.93 125.09 37.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.136 0.493 . . . . 0.0 111.708 -178.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 22.9 m -128.25 153.08 37.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.607 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.7 m -72.65 134.37 45.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.144 0.497 . . . . 0.0 111.807 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.5 t -144.38 161.55 38.72 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.349 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.1 ttmt -144.29 156.47 44.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.21 0.529 . . . . 0.0 111.895 -179.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.3 tp -134.91 129.76 51.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.027 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -88.98 115.48 26.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.63 0.252 . . . . 0.0 111.48 -178.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.0 mp -87.0 -14.99 40.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.511 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -46.18 79.2 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -178.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -92.23 -10.0 40.15 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -96.7 -64.93 1.0 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.446 HD13 ' CD1' ' A' ' 50' ' ' TRP . 21.1 mm -79.86 146.03 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.537 178.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -137.82 171.34 14.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.804 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.426 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 28.9 t30 -111.4 108.01 17.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.618 -179.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.5 mm -108.65 89.06 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.645 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 54.8 t0 66.13 39.0 4.47 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.305 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.14 0.47 89.58 Favored Glycine 0 CA--C 1.519 0.32 0 C-N-CA 120.872 -0.68 . . . . 0.0 113.32 179.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 52.6 m -110.16 136.36 49.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.077 0.439 . . . . 0.0 110.78 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.2 mt -77.23 117.52 18.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.639 0.733 . . . . 0.0 111.359 -178.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -137.57 162.54 33.5 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 114.706 -1.134 . . . . 0.0 110.354 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CD1' HD13 ' A' ' 41' ' ' ILE . 9.9 m-90 -86.91 119.3 26.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.992 0.425 . . . . 0.0 111.072 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.423 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 32.4 tt0 -173.05 143.24 1.08 Allowed Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.658 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 32.0 Cg_endo -64.72 72.59 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.019 1.812 . . . . 0.0 112.544 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.2 p -162.85 136.01 5.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.87 -1.059 . . . . 0.0 108.882 179.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -83.01 109.88 17.48 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.407 ' HA ' ' CB ' ' A' ' 43' ' ' ASN . 29.4 p90 -49.95 -30.31 10.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.919 178.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.1 p -49.17 -18.58 0.35 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -63.22 -25.49 68.36 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.853 -0.339 . . . . 0.0 111.455 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.426 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.8 p -131.5 -0.64 3.96 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.545 179.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.3 m -109.72 148.62 31.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.113 0.482 . . . . 0.0 112.016 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -142.4 157.38 44.84 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.684 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 21.5 m120 63.38 45.08 5.07 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.61 -179.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 67.6 m -68.0 137.37 55.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.56 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.88 152.44 42.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.801 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.429 HG13 ' HB2' ' A' ' 13' ' ' LEU . 35.4 mt -130.93 139.29 51.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.291 0.567 . . . . 0.0 111.932 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -136.86 110.32 7.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.82 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.73 -121.54 12.53 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.466 -0.874 . . . . 0.0 111.202 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.8 p -101.61 -4.32 26.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.1 t -101.54 141.12 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.3 tp -102.71 123.53 46.57 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.439 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.3 m -114.46 124.4 51.83 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.3 t -152.15 153.8 34.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.63 0.252 . . . . 0.0 111.399 -178.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 16.3 m -94.85 126.56 40.25 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 87.9 m -125.86 145.49 50.22 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -75.06 136.45 41.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.261 177.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 45.3 mtp180 -93.07 144.47 25.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.714 0.292 . . . . 0.0 110.944 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 46.8 m -52.21 -25.87 10.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.641 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -82.36 0.28 42.54 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.76 0.314 . . . . 0.0 111.174 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.45 135.38 7.03 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.89 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 113.83 -166.04 12.11 Favored Glycine 0 C--N 1.319 -0.378 0 N-CA-C 111.447 -0.661 . . . . 0.0 111.447 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -131.41 143.82 50.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 117.148 0.474 . . . . 0.0 111.295 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -154.25 130.79 10.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.267 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.0 t -94.31 134.88 36.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.664 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.6 p -123.27 158.41 31.01 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.662 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.7 p -122.64 146.63 47.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.849 0.357 . . . . 0.0 111.174 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.9 tt -145.81 143.2 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.803 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -97.1 117.29 30.97 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.853 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 11.1 mt -98.78 -4.62 32.94 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -178.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -44.77 -27.25 0.48 Allowed 'General case' 0 N--CA 1.469 0.515 0 O-C-N 122.0 -0.438 . . . . 0.0 112.101 -178.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.1 t -81.77 -41.94 20.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.444 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.0 m -70.72 -52.45 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -177.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.444 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -83.43 147.1 6.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 120.941 0.401 . . . . 0.0 111.58 -178.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 36.1 tt0 -137.71 164.29 29.23 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.886 -178.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -106.04 99.69 9.27 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-O 121.195 0.522 . . . . 0.0 110.697 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -98.05 97.56 6.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.29 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.8 t0 52.46 32.29 11.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.61 0.243 . . . . 0.0 111.617 179.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.38 28.42 10.61 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.823 -0.703 . . . . 0.0 113.429 179.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.8 t -142.07 136.24 29.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.833 0.349 . . . . 0.0 111.463 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.434 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 78.9 mt -74.35 120.51 20.02 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.718 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.407 ' O ' ' N ' ' A' ' 92' ' ' GLU . 17.3 mttt -126.35 145.76 50.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.949 -178.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 53.3 t80 . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.103 179.874 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.47 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 25.5 p90 . . . . . 0 N--CA 1.464 0.241 0 CA-C-O 120.63 0.253 . . . . 0.0 111.409 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.423 ' O ' HG13 ' A' ' 5' ' ' ILE . 5.1 tp -66.4 -14.6 17.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.713 0.292 . . . . 0.0 111.447 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -77.29 -27.52 53.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 0.0 110.683 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.9 p -118.68 19.11 13.3 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.258 179.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.6 m -133.1 154.48 50.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.04 0.448 . . . . 0.0 111.374 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.59 172.41 12.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.964 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 p30 49.4 57.68 6.23 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.4 p -79.85 133.17 36.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 177.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -158.56 163.89 36.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.592 -179.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.439 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.7 OUTLIER -97.56 136.47 37.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.268 0.556 . . . . 0.0 111.167 -179.745 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.22 143.26 48.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.282 179.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.14 -150.31 37.0 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 119.884 -1.15 . . . . 0.0 111.565 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -86.29 -37.12 18.87 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -178.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.19 35.33 1.52 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -114.67 149.65 36.4 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.986 0.422 . . . . 0.0 111.679 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 14.2 tp -122.87 123.89 42.0 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.35 143.12 47.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.877 0.37 . . . . 0.0 110.212 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.82 172.86 15.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.255 -178.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -109.36 135.08 51.0 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.6 m -130.61 131.86 45.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.154 0.502 . . . . 0.0 111.415 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 0.4 OUTLIER -66.03 137.06 56.83 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.459 -179.491 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 75.8 p -86.52 -178.15 6.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.481 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.3 mmt180 -60.38 -29.05 68.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.714 0.293 . . . . 0.0 111.247 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.85 9.18 10.44 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -178.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 66.77 37.29 4.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.119 0.485 . . . . 0.0 111.393 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.451 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 27.3 mm-40 -118.18 137.81 52.74 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 177.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -93.15 125.04 37.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.946 0.403 . . . . 0.0 111.548 -178.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.4 m -128.42 150.08 33.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.733 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 20.5 t -70.92 133.65 46.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.076 0.465 . . . . 0.0 111.41 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.7 t -144.59 161.53 38.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.464 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -143.1 157.91 44.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.396 0.617 . . . . 0.0 112.049 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.419 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.1 tp -137.08 128.56 42.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.142 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -88.23 116.78 26.67 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.6 mp -86.27 -14.44 43.72 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.544 178.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.406 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -56.19 -48.91 75.44 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.251 0.464 . . . . 0.0 112.251 -178.461 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.83 -10.48 39.63 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 122.014 -0.429 . . . . 0.0 111.56 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.427 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 32.2 m-70 -96.07 -64.5 1.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 2.1 mp -80.26 148.51 5.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.276 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.412 ' HB1' ' HB2' ' A' ' 51' ' ' GLN . . . -141.15 171.63 13.8 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.784 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.45 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 25.0 t30 -113.19 112.29 23.53 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.324 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.425 ' CD1' ' HB2' ' A' ' 49' ' ' LYS . 2.5 mp -112.97 89.28 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.141 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t0 68.43 37.02 2.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.252 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.95 0.28 87.43 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.425 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.3 m -109.81 135.02 51.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 117.254 0.527 . . . . 0.0 110.729 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.7 mt -77.31 116.56 18.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.838 0.828 . . . . 0.0 111.335 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.425 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 61.0 mttt -139.42 163.57 32.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.109 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.447 ' CE2' HG12 ' A' ' 90' ' ' VAL . 9.5 m-90 -87.83 127.82 35.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.091 0.472 . . . . 0.0 112.246 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.412 ' HB2' ' HB1' ' A' ' 42' ' ' ALA . 1.5 mt-30 -172.57 152.21 2.54 Favored Pre-proline 0 N--CA 1.467 0.385 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.896 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.3 62.21 2.68 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 121.86 1.707 . . . . 0.0 112.029 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.51 135.34 10.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.633 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.403 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.77 110.99 16.8 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -177.852 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.442 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 39.5 p90 -48.32 -29.63 4.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.512 178.264 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.0 p -49.02 -17.82 0.24 Allowed 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -179.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -63.01 -28.67 70.26 Favored 'General case' 0 C--N 1.332 -0.166 0 O-C-N 122.163 -0.336 . . . . 0.0 111.141 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.45 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -128.56 -0.05 5.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.522 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.3 m -111.47 148.73 32.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.316 0.579 . . . . 0.0 112.395 -178.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -143.3 157.86 44.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.132 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 63.64 45.34 4.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.013 0.435 . . . . 0.0 110.887 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 74.9 m -70.33 137.26 50.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.828 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.77 151.65 41.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.4 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.49 HD13 HG23 ' A' ' 64' ' ' ILE . 57.5 mt -130.58 141.18 46.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.353 0.597 . . . . 0.0 112.094 -179.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -137.0 109.05 7.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.318 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.38 -119.93 12.35 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.446 -0.883 . . . . 0.0 111.689 -178.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 25.8 p -100.69 -4.71 27.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 t -103.18 140.59 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-O 121.041 0.448 . . . . 0.0 112.208 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.0 tp -103.37 126.93 50.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.516 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.8 m -115.71 125.54 52.95 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 t -151.57 153.43 34.51 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.297 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 6.2 m -95.02 126.0 40.06 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.6 m -126.44 145.18 50.58 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -74.77 137.3 41.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.954 178.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 49.2 mtm180 -91.93 144.49 25.41 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.348 179.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.4 m -51.98 -27.03 11.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.579 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -82.85 1.55 38.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.354 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.96 137.82 7.4 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.314 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.75 -168.16 12.49 Favored Glycine 0 C--N 1.319 -0.386 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -178.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -133.7 143.32 48.44 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 117.379 0.59 . . . . 0.0 111.431 -179.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -154.14 131.28 11.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.185 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -93.48 134.46 35.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.612 -179.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.6 p -121.73 158.09 29.52 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.189 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 78.7 p -122.74 144.34 49.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.383 . . . . 0.0 111.136 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.405 HD11 ' CZ2' ' A' ' 50' ' ' TRP . 13.8 tt -145.13 142.93 22.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.64 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -96.86 116.18 28.72 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.401 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 mt -96.71 -4.3 41.01 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.47 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 11.9 t-20 -44.45 -26.91 0.39 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.0 m -81.86 -40.98 21.65 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.447 HG12 ' CE2' ' A' ' 50' ' ' TRP . 3.8 m -72.98 -52.64 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 113.485 0.921 . . . . 0.0 113.485 -177.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.453 ' HB ' ' CD1' ' A' ' 4' ' ' PHE . 2.7 mp -81.83 147.57 6.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.042 0.448 . . . . 0.0 111.319 -179.201 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.408 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 20.0 tt0 -139.88 166.19 25.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.013 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -106.8 99.61 9.17 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-O 121.207 0.527 . . . . 0.0 110.349 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.8 t -98.46 98.0 6.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.616 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.7 t0 53.57 33.23 15.86 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.93 28.41 12.11 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.766 -0.731 . . . . 0.0 113.79 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.6 m -141.38 137.89 32.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.907 0.384 . . . . 0.0 111.108 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.419 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 67.8 mt -73.91 119.66 18.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.365 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 16.3 mttt -123.92 139.27 54.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.844 -178.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.427 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 20.3 t80 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.233 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.458 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 19.2 p90 . . . . . 0 N--CA 1.464 0.264 0 CA-C-O 120.641 0.257 . . . . 0.0 111.359 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.403 ' O ' HG13 ' A' ' 5' ' ' ILE . 5.2 tp -68.12 -10.43 12.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 120.705 0.288 . . . . 0.0 111.469 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -77.28 -25.88 51.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.842 0.353 . . . . 0.0 110.798 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.3 p -118.31 -2.35 11.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.75 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.2 m -110.51 152.71 26.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.123 0.487 . . . . 0.0 111.143 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.406 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 1.2 ptm180 -132.87 172.84 12.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.606 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.408 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.4 p-10 50.13 56.97 7.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.951 0.405 . . . . 0.0 112.017 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.3 p -79.52 132.72 36.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.998 178.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -157.19 163.3 39.0 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.281 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.485 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.5 OUTLIER -97.56 136.1 38.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.789 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.58 145.65 47.14 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.027 179.176 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.67 -153.4 29.11 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 119.731 -1.224 . . . . 0.0 111.196 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.2 -36.85 19.21 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.22 35.94 1.9 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 15.3 mp0 -116.67 147.66 41.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.088 0.471 . . . . 0.0 111.737 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.405 ' HB2' HD12 ' A' ' 37' ' ' LEU . 13.6 tp -121.75 125.55 46.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.536 -0.756 . . . . 0.0 108.988 178.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.04 142.69 47.12 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.867 0.365 . . . . 0.0 110.104 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.11 172.17 17.25 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.118 -178.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -114.33 134.77 54.72 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 177.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 59.3 m -130.49 133.32 46.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.148 0.499 . . . . 0.0 111.693 -178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 1.3 pttt -66.47 136.06 55.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.335 -179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 46.0 p -84.51 -176.98 6.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.503 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.2 mmt180 -62.33 -29.79 70.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.145 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.74 9.78 7.29 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 66.77 37.29 4.24 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.144 0.497 . . . . 0.0 111.397 -178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 28.2 mt-30 -118.51 137.47 53.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.088 178.241 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -94.23 126.5 39.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.898 0.38 . . . . 0.0 111.625 -178.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 25.6 m -131.04 153.0 38.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.051 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.9 m -73.16 134.11 44.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.12 0.486 . . . . 0.0 111.547 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.0 t -144.59 161.48 39.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.062 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.6 ttpt -141.4 156.84 45.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.454 0.645 . . . . 0.0 112.234 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.1 tp -136.83 123.76 30.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 114.899 -1.046 . . . . 0.0 108.566 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -86.8 118.75 26.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.693 0.282 . . . . 0.0 110.673 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.428 ' O ' ' N ' ' A' ' 41' ' ' ILE . 4.3 mp -86.95 -14.98 40.22 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.491 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.1 p-10 -57.28 -43.73 83.36 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.288 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.1 p30 -91.8 -10.06 41.24 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 122.247 -0.283 . . . . 0.0 111.433 179.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.406 ' CE1' ' CB ' ' A' ' 100' ' ' TYR . 46.7 m-70 -99.84 -64.19 1.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.439 HD12 ' CD1' ' A' ' 50' ' ' TRP . 26.0 mm -78.64 146.97 7.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.53 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.441 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -139.56 172.01 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.611 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.496 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 26.7 t30 -112.74 108.25 17.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.824 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.2 mm -109.18 89.54 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.03 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.7 t70 68.3 39.54 2.27 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.138 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.3 0.71 90.04 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.903 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.8 m -110.61 137.2 48.6 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.845 0.355 . . . . 0.0 110.762 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 11.5 mt -77.21 116.78 18.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.609 0.718 . . . . 0.0 111.281 -178.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -135.49 162.09 33.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.805 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.45 ' CE2' HG13 ' A' ' 90' ' ' VAL . 6.1 m-90 -86.21 121.55 28.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.993 0.425 . . . . 0.0 111.476 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.424 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 40.5 tt0 -174.17 150.36 1.56 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.38 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.446 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 7.3 Cg_exo -70.42 65.64 2.18 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.237 1.958 . . . . 0.0 112.369 -179.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.441 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 24.6 p -157.45 134.72 10.36 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.394 178.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.436 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.36 108.12 14.71 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -177.557 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.413 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 40.9 p90 -47.67 -30.69 3.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.22 178.267 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.6 p -47.26 -18.4 0.1 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.853 -179.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -65.08 -27.06 68.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.614 0.245 . . . . 0.0 111.535 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.496 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.5 p -129.22 -1.4 5.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.451 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -111.69 149.62 31.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.184 0.516 . . . . 0.0 111.916 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -142.19 157.58 44.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.735 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.4 m120 64.13 48.7 2.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.981 0.419 . . . . 0.0 110.657 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 62.8 m -71.37 134.27 46.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.555 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.78 151.84 43.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.561 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.485 HG13 ' HB2' ' A' ' 13' ' ' LEU . 34.6 mt -130.4 141.52 46.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-O 121.353 0.597 . . . . 0.0 112.185 -179.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -137.74 109.0 6.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.887 178.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.17 -121.83 12.07 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.464 -0.874 . . . . 0.0 111.332 -178.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.2 p -102.47 -2.69 28.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.0 t -102.36 139.32 23.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.952 0.406 . . . . 0.0 111.592 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.3 tp -102.35 128.2 49.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.628 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.2 m -116.8 123.92 48.29 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.1 t -151.63 153.28 34.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.608 0.242 . . . . 0.0 111.21 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.6 m -94.83 126.15 39.96 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.406 ' HB3' ' OD1' ' A' ' 43' ' ' ASN . 81.4 m -125.59 144.32 50.63 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -74.52 136.98 42.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.587 178.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -92.53 142.32 27.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.717 0.294 . . . . 0.0 110.583 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.1 m -52.13 -26.26 10.86 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.619 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -83.18 1.36 40.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.659 0.266 . . . . 0.0 111.532 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.13 133.42 6.53 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.804 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.83 -169.02 12.8 Favored Glycine 0 C--N 1.317 -0.483 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 -178.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -132.26 144.03 50.32 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 117.238 0.519 . . . . 0.0 111.413 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -154.11 129.98 10.17 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.558 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.4 t -91.82 134.67 34.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.41 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 29.7 p -123.42 158.04 32.06 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.402 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.0 m -122.45 145.53 48.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.02 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 13.9 tt -144.78 143.37 22.74 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.725 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -96.43 116.18 28.64 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.103 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.415 ' O ' HG22 ' A' ' 90' ' ' VAL . 11.6 mt -96.95 -6.99 34.28 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -179.117 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.458 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 13.2 t-20 -44.86 -28.19 0.62 Allowed 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -178.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.4 m -81.98 -38.23 25.46 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.469 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 2.9 m -74.4 -53.46 17.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -178.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.469 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.2 147.63 5.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.06 0.457 . . . . 0.0 111.268 -178.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.427 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 9.9 tt0 -137.32 166.54 23.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.157 -178.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -107.21 99.42 8.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.121 0.486 . . . . 0.0 110.184 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.417 HG23 ' CD ' ' A' ' 99' ' ' LYS . 33.1 t -98.28 96.08 4.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.196 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.3 t0 53.09 33.47 15.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.655 0.264 . . . . 0.0 111.466 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.59 28.65 12.17 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.269 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 62.5 p -140.92 133.76 29.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.802 0.334 . . . . 0.0 110.912 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.427 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 77.4 mt -74.49 121.07 20.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.732 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.455 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 8.5 mttm -125.11 137.0 54.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.076 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.406 ' CB ' ' CE1' ' A' ' 40' ' ' HIS . 39.1 t80 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.649 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.438 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 14.1 p90 . . . . . 0 N--CA 1.464 0.266 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.0 tp -63.87 -19.33 24.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.633 0.254 . . . . 0.0 111.446 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -75.45 -26.79 58.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.819 0.342 . . . . 0.0 110.855 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.7 p -118.66 13.95 13.43 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.537 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 71.1 m -127.11 153.6 45.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.037 0.446 . . . . 0.0 111.477 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -133.1 172.58 12.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.96 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.0 p30 49.62 57.66 6.27 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.3 p -79.65 134.15 36.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.015 178.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -158.86 163.84 36.26 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.132 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.456 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.39 136.22 38.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.177 0.513 . . . . 0.0 110.991 -179.779 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.74 145.01 46.93 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.381 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.62 -152.38 30.95 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.55 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -85.89 -37.14 19.45 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -142.11 35.54 1.54 Allowed 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -114.34 146.91 39.93 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.927 0.394 . . . . 0.0 111.48 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 14.0 tp -120.3 124.49 45.72 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.74 144.55 48.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.94 0.4 . . . . 0.0 110.048 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.79 172.8 15.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.089 -178.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -109.78 133.98 52.53 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 83.0 m -130.67 134.11 46.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.191 0.52 . . . . 0.0 112.139 -178.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.6 ptpt -66.43 137.3 56.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.506 -179.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.8 p -86.06 -179.52 6.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.447 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -60.36 -29.87 69.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.655 0.264 . . . . 0.0 111.134 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.66 10.39 9.38 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 66.88 39.74 3.29 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.207 0.527 . . . . 0.0 112.052 -179.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.419 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 68.1 mt-30 -119.96 136.03 54.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.403 -0.817 . . . . 0.0 108.853 177.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -92.09 126.39 37.15 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.023 0.439 . . . . 0.0 111.958 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 29.3 m -131.09 152.49 37.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.163 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.3 t -72.96 134.39 44.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.135 0.493 . . . . 0.0 111.667 -179.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 t -145.76 161.57 39.62 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.362 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -144.04 157.17 44.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.353 0.597 . . . . 0.0 112.139 -179.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -135.21 129.4 50.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.834 179.498 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -88.52 116.44 26.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.558 0.218 . . . . 0.0 111.414 -178.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.2 mp -87.58 -15.91 36.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.325 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -47.28 73.44 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -178.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.423 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 3.2 m-20 -92.26 -10.33 38.9 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 122.169 -0.332 . . . . 0.0 111.755 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -96.29 -64.9 1.01 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.428 ' N ' ' CD1' ' A' ' 41' ' ' ILE . 1.9 mp -82.53 147.71 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.419 178.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -141.3 171.99 13.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.815 -0.629 . . . . 0.0 112.081 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.431 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 22.6 t30 -112.87 113.21 25.18 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.941 -179.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.418 ' CD1' ' HB2' ' A' ' 49' ' ' LYS . 2.5 mp -113.59 89.49 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.937 0.399 . . . . 0.0 111.141 179.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 50.1 t0 69.77 37.26 1.88 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.449 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.03 0.75 87.11 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.643 -0.789 . . . . 0.0 113.293 179.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 39.8 m -112.84 135.97 53.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 117.198 0.499 . . . . 0.0 110.8 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.8 mt -77.18 117.19 18.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.635 0.731 . . . . 0.0 111.733 -177.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.418 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 30.0 mmtt -137.82 162.86 32.84 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.641 179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.471 ' CE2' HG11 ' A' ' 90' ' ' VAL . 3.6 m-90 -86.51 125.06 33.49 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.031 0.443 . . . . 0.0 111.99 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -175.85 149.09 1.01 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.917 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.423 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 7.7 Cg_exo -69.04 66.75 1.34 Allowed 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.981 1.788 . . . . 0.0 112.061 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -156.81 131.38 8.74 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.184 179.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.68 109.36 15.15 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.258 0.552 . . . . 0.0 112.245 -177.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.424 ' CZ ' ' CB ' ' A' ' 17' ' ' SER . 41.1 p90 -48.15 -31.23 5.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.723 178.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.5 p -49.69 -18.28 0.44 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.676 -179.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -62.06 -30.18 70.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.597 0.237 . . . . 0.0 111.013 -179.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.431 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -126.74 -3.39 6.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.289 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.2 m -108.14 148.99 29.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.216 0.532 . . . . 0.0 112.118 -178.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.8 p90 -142.96 157.67 44.34 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.053 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 63.36 44.11 5.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.007 0.432 . . . . 0.0 110.728 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.3 m -68.58 136.63 53.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.618 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.47 152.1 42.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.508 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.456 HG13 ' HB2' ' A' ' 13' ' ' LEU . 39.4 mt -129.01 139.68 51.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.238 0.542 . . . . 0.0 111.866 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -134.12 107.86 7.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.44 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.99 -120.19 13.4 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.4 -0.905 . . . . 0.0 111.3 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.3 p -99.88 -4.04 31.17 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.6 t -103.15 140.09 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.5 tp -103.16 125.57 49.92 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.573 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.1 m -115.3 125.74 53.64 Favored 'General case' 0 N--CA 1.461 0.108 0 N-CA-C 110.094 -0.335 . . . . 0.0 110.094 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.3 t -151.86 153.59 34.5 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.69 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 10.7 m -95.53 126.12 40.59 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 70.8 m -127.45 146.7 50.4 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -178.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -75.27 137.1 40.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.108 178.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 30.5 mtm180 -91.98 143.98 25.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.19 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 14.2 m -51.83 -27.17 11.64 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -179.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -82.39 1.81 35.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.694 0.283 . . . . 0.0 111.436 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.92 136.04 7.54 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.817 179.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.18 -166.85 12.23 Favored Glycine 0 C--N 1.319 -0.362 0 N-CA-C 111.658 -0.577 . . . . 0.0 111.658 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -133.32 143.09 48.79 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.979 0.419 . . . . 0.0 111.163 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -154.3 132.95 12.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.119 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.3 t -94.22 134.38 36.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.842 0.353 . . . . 0.0 111.656 -179.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.5 p -119.8 157.76 27.96 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.192 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.7 m -121.44 142.38 50.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.916 0.389 . . . . 0.0 111.088 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.432 HD12 ' CH2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -147.78 144.51 19.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.613 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -101.05 121.33 41.61 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.285 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.427 ' O ' HG21 ' A' ' 90' ' ' VAL . 2.3 mt -100.66 -3.22 30.77 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -179.405 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.438 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 5.3 t-20 -45.3 -26.92 0.58 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.91 -42.12 24.77 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.471 HG11 ' CE2' ' A' ' 50' ' ' TRP . 4.1 m -72.63 -51.32 28.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -177.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.441 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -81.78 147.3 6.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.037 0.446 . . . . 0.0 111.347 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 99' ' ' LYS . 3.9 tt0 -138.62 166.8 23.42 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.972 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -107.69 99.93 9.37 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.191 0.52 . . . . 0.0 110.855 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.3 t -98.89 97.14 5.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.13 179.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.8 t0 53.79 33.13 16.24 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.7 28.4 12.53 Favored Glycine 0 CA--C 1.518 0.271 0 C-N-CA 120.585 -0.817 . . . . 0.0 113.206 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.9 m -141.41 135.48 30.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.867 0.365 . . . . 0.0 111.318 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 28.1 mt -74.39 119.4 18.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.44 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.404 ' O ' ' N ' ' A' ' 92' ' ' GLU . 0.3 OUTLIER -125.31 135.64 52.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.321 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 8.5 t80 . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.678 178.799 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.1 p90 . . . . . 0 N--CA 1.464 0.241 0 CA-C-O 120.706 0.289 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.406 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 4.4 tp -62.48 -21.11 26.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.389 -179.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -72.15 -24.28 61.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.744 0.307 . . . . 0.0 110.598 179.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.6 p -119.09 -3.99 10.6 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 86.3 m -107.19 152.07 24.56 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.811 0.339 . . . . 0.0 111.188 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -131.65 173.25 11.32 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.719 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 47.1 57.73 5.46 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 82.1 p -78.82 132.46 36.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.872 178.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -158.57 164.34 36.17 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.959 0.409 . . . . 0.0 111.667 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.474 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.9 OUTLIER -97.5 135.8 38.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.497 -179.315 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.13 145.1 46.25 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.257 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 56.64 -150.27 27.16 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.318 -0.944 . . . . 0.0 111.425 -178.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.35 -37.82 18.08 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.789 0.662 . . . . 0.0 112.789 -178.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.43 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.9 p -141.17 37.1 1.73 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -114.66 148.75 37.74 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.943 0.401 . . . . 0.0 111.869 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.406 ' N ' ' CD1' ' A' ' 37' ' ' LEU . 17.1 tp -121.89 122.35 39.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.191 179.198 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.73 143.43 46.22 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.38 172.68 16.13 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -113.63 133.36 55.34 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 54.7 m -130.47 132.78 45.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.148 0.499 . . . . 0.0 111.519 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -64.84 137.95 58.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.671 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 52.6 p -86.6 -177.42 6.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.771 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.8 mtp85 -61.48 -29.36 69.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.028 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.43 8.84 12.59 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 67.04 36.83 4.02 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.163 0.506 . . . . 0.0 111.274 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -117.07 134.53 54.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -90.99 124.92 35.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.119 0.485 . . . . 0.0 111.817 -178.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.6 m -130.16 150.86 35.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.635 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.7 t -72.03 136.57 46.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.345 0.593 . . . . 0.0 111.776 -178.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.7 t -145.34 162.35 37.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.212 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.404 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.9 OUTLIER -144.7 156.1 43.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.537 0.685 . . . . 0.0 111.92 -179.172 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.404 ' N ' ' HG2' ' A' ' 34' ' ' LYS . 1.0 OUTLIER -135.38 126.8 45.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.633 179.173 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -87.58 114.65 24.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.703 0.287 . . . . 0.0 110.807 -178.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.406 ' CD1' ' N ' ' A' ' 19' ' ' LEU . 3.6 mp -86.15 -15.51 40.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.952 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -46.04 78.29 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.631 -0.428 . . . . 0.0 111.591 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.55 -10.2 41.49 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.45 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 30.3 m-70 -96.61 -60.34 1.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.428 HD13 ' CD1' ' A' ' 50' ' ' TRP . 32.8 mm -81.03 146.75 6.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.571 178.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.424 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -139.56 170.14 16.45 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.395 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.43 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 34.7 t30 -111.92 108.69 18.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.86 -179.249 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 48.2 mm -108.51 88.76 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.791 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 53.8 t0 66.43 39.42 3.94 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.827 0.346 . . . . 0.0 111.563 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.78 0.38 89.79 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 121.007 -0.616 . . . . 0.0 113.404 179.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.0 m -109.02 136.33 48.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 117.009 0.405 . . . . 0.0 110.958 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.6 mt -77.57 117.03 18.61 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.519 0.676 . . . . 0.0 111.408 -178.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.7 mmtt -138.39 163.51 31.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.607 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.448 ' CZ2' HG11 ' A' ' 90' ' ' VAL . 7.4 m-90 -84.77 124.27 31.37 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.976 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.05 146.78 1.43 Allowed Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.848 -178.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -70.56 65.62 2.26 Favored 'Trans proline' 0 C--N 1.358 1.044 0 C-N-CA 122.464 2.11 . . . . 0.0 111.571 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.424 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.1 p -159.62 132.11 6.61 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.467 -1.242 . . . . 0.0 107.998 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.57 109.69 15.34 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -177.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.0 p90 -48.64 -30.31 5.3 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.974 177.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 35.4 p -49.92 -18.76 0.56 Allowed 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -63.1 -26.43 68.83 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.818 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.43 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 3.9 p -129.76 0.72 4.88 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.302 178.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.5 m -111.84 148.16 34.21 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.321 0.582 . . . . 0.0 112.268 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 35.5 p90 -141.7 157.99 44.37 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.528 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 64.3 42.56 5.25 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.838 0.351 . . . . 0.0 110.959 -179.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 55.0 m -68.57 137.88 54.66 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.498 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.84 150.99 39.32 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.878 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.474 HG13 ' HB2' ' A' ' 13' ' ' LEU . 21.4 mt -129.09 140.24 49.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.47 0.652 . . . . 0.0 112.34 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -137.84 108.85 6.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.036 179.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.59 -122.64 12.44 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.322 -0.942 . . . . 0.0 111.145 -178.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.6 p -100.91 -5.46 26.0 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.2 t -101.1 140.77 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 120.995 0.426 . . . . 0.0 111.845 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.0 tp -104.28 127.61 51.94 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.655 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.0 m -116.28 123.81 48.61 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.865 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.3 t -151.47 153.28 34.33 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.242 -0.183 . . . . 0.0 111.304 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.449 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.5 m -95.45 126.11 40.52 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 72.7 m -125.8 145.16 50.34 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -75.78 136.84 40.26 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.598 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 45.3 mtm180 -91.78 146.19 23.96 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.634 0.254 . . . . 0.0 110.693 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.4 m -52.25 -30.39 27.47 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -82.26 1.52 36.33 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.481 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.43 137.04 6.75 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.481 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 118.45 -176.43 16.11 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -127.73 141.58 51.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.576 0.688 . . . . 0.0 110.903 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -153.84 128.8 9.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.015 0.436 . . . . 0.0 110.665 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.449 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -92.18 135.48 33.96 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.894 -179.325 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.3 p -122.46 158.22 30.24 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.102 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 58.2 m -124.95 146.26 49.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.882 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.417 HD13 ' CZ3' ' A' ' 50' ' ' TRP . 12.2 tt -146.34 143.69 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.769 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -95.41 119.72 34.39 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.386 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 7.1 mt -100.23 -5.81 27.0 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.406 ' ND2' ' CG2' ' A' ' 5' ' ' ILE . 11.1 t-20 -44.5 -29.1 0.66 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.13 -38.37 27.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.448 HG11 ' CZ2' ' A' ' 50' ' ' TRP . 3.1 m -74.42 -52.43 19.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -178.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.422 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -82.81 146.37 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-O 120.859 0.362 . . . . 0.0 111.866 -178.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -135.75 164.04 28.8 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.223 -178.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -107.05 99.75 9.28 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.38 0.61 . . . . 0.0 111.019 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 52.4 t -97.02 97.07 5.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.867 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.1 t0 51.65 33.3 10.57 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.03 28.75 9.63 Favored Glycine 0 C--N 1.329 0.168 0 C-N-CA 120.444 -0.884 . . . . 0.0 113.104 178.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 69.8 m -142.07 135.21 28.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.89 0.376 . . . . 0.0 111.035 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 44.5 mt -75.11 121.89 22.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.192 -179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.1 mttm -126.59 134.35 50.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.118 0.485 . . . . 0.0 112.178 -179.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.45 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 10.1 t80 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.43 179.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.419 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 16.0 p90 . . . . . 0 N--CA 1.467 0.38 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.402 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 8.2 tp -61.41 -20.73 23.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -74.12 -25.28 59.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.311 179.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.5 p -118.75 -5.95 10.63 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.667 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 66.3 m -104.91 152.77 22.24 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.08 0.467 . . . . 0.0 111.122 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -132.18 172.86 11.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.963 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 47.33 58.33 4.98 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.015 0.436 . . . . 0.0 111.721 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 54.4 p -79.11 130.27 35.33 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.664 178.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -156.67 164.13 38.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.778 -178.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.412 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.7 OUTLIER -97.45 136.89 37.23 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.918 -179.902 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.82 144.23 48.45 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 60.27 -152.63 36.95 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 119.818 -1.182 . . . . 0.0 111.589 -179.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.7 m -86.64 -36.32 18.85 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.406 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.9 p -142.65 34.67 1.43 Allowed 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -178.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -113.51 151.22 31.82 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.957 0.408 . . . . 0.0 112.081 178.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.425 ' N ' ' CD1' ' A' ' 37' ' ' LEU . 11.4 tp -124.85 124.88 43.02 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.185 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.55 143.34 48.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.69 172.74 15.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.176 -178.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -114.43 133.94 55.36 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 32.3 m -130.74 132.98 45.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.114 0.483 . . . . 0.0 111.877 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -65.74 137.83 57.53 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.435 -179.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 54.7 p -85.16 -176.31 6.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.575 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -62.34 -30.12 70.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.915 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.51 9.02 10.1 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 66.95 37.9 3.77 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.035 0.445 . . . . 0.0 111.806 -178.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -118.77 135.66 54.39 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 177.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -90.6 124.98 35.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.921 0.391 . . . . 0.0 111.995 -178.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.9 m -129.79 148.54 33.21 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.755 179.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.3 m -70.25 135.1 48.67 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.22 0.533 . . . . 0.0 111.959 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -144.62 161.81 38.22 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.344 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.7 ttpt -142.92 157.43 44.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.531 0.682 . . . . 0.0 112.333 -179.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . 0.413 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 0.9 OUTLIER -137.12 126.84 37.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.039 179.826 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -88.47 115.0 25.67 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.886 0.374 . . . . 0.0 111.535 -178.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.425 ' CD1' ' N ' ' A' ' 19' ' ' LEU . 2.8 mp -85.66 -16.42 39.18 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.543 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.403 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -55.84 -48.15 75.99 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.637 0.256 . . . . 0.0 111.214 -179.047 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.408 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.2 OUTLIER -91.47 -10.43 40.89 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.736 -0.386 . . . . 0.0 111.594 179.515 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -95.05 -66.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.408 HD13 HD22 ' A' ' 37' ' ' LEU . 45.3 mt -79.85 151.19 4.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.747 178.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -141.35 172.28 12.91 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.029 -179.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.417 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 37.1 t30 -109.2 109.68 20.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.809 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 44.7 mm -110.7 88.93 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.637 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.7 t70 68.15 39.84 2.31 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.604 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.15 1.14 90.52 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 120.625 -0.798 . . . . 0.0 113.094 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.3 m -112.54 137.05 51.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.88 0.371 . . . . 0.0 110.953 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 52.1 mt -76.66 116.07 17.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.548 0.69 . . . . 0.0 110.58 -178.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -135.18 161.96 33.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.609 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.471 ' CZ2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -87.78 120.89 29.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.991 0.424 . . . . 0.0 111.512 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.409 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 20.2 tt0 -175.25 143.73 0.76 Allowed Pre-proline 0 N--CA 1.465 0.28 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.823 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.409 ' HD2' ' HG3' ' A' ' 51' ' ' GLN . 33.6 Cg_endo -64.25 75.71 0.18 Allowed 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 121.983 1.789 . . . . 0.0 112.91 -179.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -165.68 133.5 2.98 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.332 179.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.07 110.0 16.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.231 0.539 . . . . 0.0 112.151 -178.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.406 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.2 p90 -49.58 -29.16 6.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.573 178.451 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 61.5 p -49.6 -17.7 0.35 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -62.51 -28.14 69.64 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.595 0.235 . . . . 0.0 111.216 -179.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.417 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.4 p -129.84 -1.25 4.76 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.9 m -109.49 147.62 32.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.332 0.587 . . . . 0.0 112.482 -178.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -142.92 158.52 43.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.605 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 64.31 43.53 4.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.858 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 74.3 m -68.64 137.06 53.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.931 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -144.0 152.93 41.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.291 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.412 HG13 ' HB2' ' A' ' 13' ' ' LEU . 43.5 mt -130.47 140.87 47.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.254 0.549 . . . . 0.0 111.717 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -137.17 107.96 6.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.668 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.71 -122.29 11.84 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.615 -0.802 . . . . 0.0 111.631 -178.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.5 p -101.08 -5.33 25.87 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.6 t -101.41 139.56 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 120.882 0.372 . . . . 0.0 111.672 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.8 tp -101.67 127.73 48.29 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.675 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.2 m -116.75 123.12 46.39 Favored 'General case' 0 N--CA 1.461 0.099 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.1 t -151.96 153.99 35.17 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.748 -178.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.45 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.5 m -94.34 125.66 39.12 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 178.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 88.4 m -125.61 142.87 51.28 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.228 0.537 . . . . 0.0 112.445 -178.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -74.46 138.5 43.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.728 178.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.5 mtp180 -91.43 144.56 25.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.629 0.252 . . . . 0.0 110.629 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 24.6 m -52.62 -27.65 17.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.326 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -82.16 2.45 31.45 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.678 0.275 . . . . 0.0 111.208 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.78 136.46 6.7 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.726 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.59 -170.24 13.22 Favored Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 111.245 -0.742 . . . . 0.0 111.245 -178.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -130.73 142.36 50.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 117.23 0.515 . . . . 0.0 111.226 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -154.0 130.15 10.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.459 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.45 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.4 t -93.39 134.9 35.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.037 0.446 . . . . 0.0 111.743 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 89.7 p -122.22 158.49 29.33 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.344 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.4 m -122.76 146.05 47.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.823 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.7 tt -147.76 143.46 19.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.037 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -97.07 119.82 36.27 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.684 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.408 ' O ' HG21 ' A' ' 90' ' ' VAL . 9.4 mt -100.71 -6.41 25.08 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -178.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.419 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 6.2 t-20 -45.09 -29.72 0.95 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -178.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.3 t -81.28 -39.45 25.21 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.471 HG11 ' CZ2' ' A' ' 50' ' ' TRP . 2.8 m -72.68 -52.1 24.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.426 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.85 147.33 6.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 0.0 110.764 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -138.49 165.94 25.55 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.097 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 29.0 t30 -106.59 99.7 9.26 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.221 0.534 . . . . 0.0 110.27 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -98.54 95.32 4.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.885 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.9 t0 52.13 32.61 10.76 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.573 0.225 . . . . 0.0 111.58 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.78 28.56 10.05 Favored Glycine 0 C--N 1.329 0.155 0 C-N-CA 120.593 -0.813 . . . . 0.0 113.635 178.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.1 m -141.65 134.33 28.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.932 0.366 . . . . 0.0 110.632 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.413 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 82.6 mt -73.26 120.6 19.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.678 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.4 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 11.7 mttt -125.91 141.07 52.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.136 0.493 . . . . 0.0 112.276 -178.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 22.6 t80 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.31 179.38 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.427 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 18.5 p90 . . . . . 0 CA--C 1.53 0.201 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.0 tp -63.4 -18.16 21.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.728 0.299 . . . . 0.0 111.495 -179.655 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -74.8 -24.31 58.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.978 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.1 p -118.71 15.1 13.57 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.649 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 56.5 m -131.47 154.09 49.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.171 0.51 . . . . 0.0 111.304 -179.655 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.4 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 6.3 ptt180 -132.76 173.19 11.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.676 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.419 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.7 p-10 48.95 56.71 7.34 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.0 p -79.37 133.75 36.59 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.565 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -158.09 164.21 36.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.845 -178.911 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.41 136.35 37.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.994 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.5 144.62 46.91 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.454 -0.794 . . . . 0.0 108.993 178.977 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.15 -152.16 29.45 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.847 -1.168 . . . . 0.0 111.846 -179.09 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.73 -36.7 20.01 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.343 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -142.53 35.92 1.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.8 mp0 -114.5 147.53 39.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.199 0.523 . . . . 0.0 111.689 179.09 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.417 ' HB2' HD11 ' A' ' 37' ' ' LEU . 17.3 tp -120.93 123.99 43.84 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.394 179.287 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.42 142.98 49.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.961 0.41 . . . . 0.0 110.105 179.712 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.59 172.64 16.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.945 -178.788 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -111.82 133.73 53.84 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 176.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.3 m -130.61 133.95 46.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.072 0.463 . . . . 0.0 111.66 -178.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.1 ptpt -67.11 137.49 56.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.704 -179.479 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.1 p -85.59 -179.19 6.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.402 179.772 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -60.63 -29.77 69.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.659 0.266 . . . . 0.0 111.12 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.58 9.36 9.56 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -178.948 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 67.04 38.52 3.46 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.146 0.498 . . . . 0.0 111.911 -179.014 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -119.53 134.95 54.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.515 -0.766 . . . . 0.0 108.968 178.06 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -92.25 124.94 36.69 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.025 0.44 . . . . 0.0 111.821 -178.62 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.2 m -129.87 150.46 34.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.735 179.667 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.8 p -71.25 134.4 46.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.239 0.542 . . . . 0.0 111.725 -178.737 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.3 t -142.74 161.86 36.97 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.295 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.6 ttmt -143.67 156.18 44.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.481 0.658 . . . . 0.0 112.187 -179.07 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.1 tp -136.53 124.94 35.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 114.998 -1.001 . . . . 0.0 108.501 179.142 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -88.24 119.02 28.24 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.709 0.29 . . . . 0.0 111.294 -177.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.417 HD11 ' HB2' ' A' ' 19' ' ' LEU . 4.0 mp -89.04 -14.72 35.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.808 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.0 p-10 -57.87 -43.44 85.99 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.754 -178.467 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.423 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.5 OUTLIER -92.77 -10.52 36.64 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.944 -0.472 . . . . 0.0 111.611 178.691 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.463 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 26.6 m-70 -97.98 -64.2 1.06 Allowed 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.5 mm -80.07 145.73 8.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.444 178.764 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.431 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -137.92 171.46 14.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.5 -179.811 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.418 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 20.2 t30 -113.12 111.71 22.58 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.251 -178.968 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.405 ' N ' ' CD1' ' A' ' 44' ' ' ILE . 2.2 mp -112.7 95.03 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.394 179.192 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.3 t0 64.12 38.06 8.6 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.078 -179.561 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.08 11.63 82.17 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.218 179.374 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.7 m -120.4 136.49 54.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.024 0.412 . . . . 0.0 110.721 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.6 mt -77.42 118.1 19.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.559 0.695 . . . . 0.0 111.624 -177.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.6 mttt -139.15 163.42 32.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.006 -179.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.433 ' CE2' HG12 ' A' ' 90' ' ' VAL . 4.8 m-90 -85.4 119.0 25.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.956 0.408 . . . . 0.0 111.78 -179.413 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.431 ' CG ' ' O ' ' A' ' 50' ' ' TRP . 18.0 mt-30 -169.4 151.45 4.51 Favored Pre-proline 0 N--CA 1.468 0.425 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.5 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.75 60.82 2.91 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 121.975 1.783 . . . . 0.0 112.394 -179.744 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.431 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.7 p -153.43 135.75 14.96 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.442 -0.799 . . . . 0.0 108.89 179.123 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -81.03 113.06 18.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -177.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 48.5 p90 -52.57 -33.49 46.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.414 178.316 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 60.1 p -48.97 -21.29 0.64 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.702 -179.11 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -62.0 -25.26 67.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.62 0.248 . . . . 0.0 110.898 -179.278 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.418 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -127.71 -2.24 6.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.127 178.797 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.8 m -111.09 148.36 32.83 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.25 0.548 . . . . 0.0 112.369 -178.277 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 41.3 p90 -140.12 157.33 45.8 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.053 179.538 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 41.1 m-20 62.99 45.15 5.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.059 0.457 . . . . 0.0 110.444 -178.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 67.3 m -70.04 136.54 50.44 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.658 179.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.57 154.0 43.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.134 -179.618 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 47.0 mt -130.8 140.12 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.59 179.526 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -134.76 108.68 8.1 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.159 -0.928 . . . . 0.0 108.549 178.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.9 -119.68 11.26 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.327 -0.939 . . . . 0.0 111.193 -178.203 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 26.7 p -102.83 -3.49 26.24 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.411 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.3 t -101.55 137.58 28.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.93 0.395 . . . . 0.0 111.844 -179.835 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.3 tp -101.03 124.79 47.29 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.781 179.536 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.6 m -114.87 126.77 55.19 Favored 'General case' 0 CA--C 1.521 -0.144 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.349 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 t -151.68 153.62 34.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.73 0.3 . . . . 0.0 111.282 -179.127 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.6 m -94.3 125.61 39.04 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.703 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 85.9 m -128.55 147.2 50.69 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.44 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -75.48 136.79 40.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.179 178.505 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -91.7 144.05 25.92 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 179.282 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.3 m -52.19 -28.58 18.79 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.053 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -80.8 2.2 27.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.676 0.274 . . . . 0.0 111.504 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.03 135.06 6.7 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.561 179.99 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.5 -168.72 12.99 Favored Glycine 0 C--N 1.318 -0.442 0 N-CA-C 111.612 -0.595 . . . . 0.0 111.612 -179.0 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -131.2 141.14 50.01 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.877 0.339 . . . . 0.0 110.992 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -154.6 132.66 11.68 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.653 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -94.44 134.55 36.84 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.784 -179.367 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.5 p -121.46 157.99 29.38 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.897 0.38 . . . . 0.0 110.63 179.696 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 8.1 p -120.76 143.92 48.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.328 -179.511 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.405 HD12 ' CZ2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -146.83 145.5 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.333 179.563 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -101.5 121.54 42.15 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.422 -179.479 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.412 ' O ' HG22 ' A' ' 90' ' ' VAL . 4.3 mt -103.46 -2.88 26.16 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -178.897 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.4 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 13.0 t-20 -44.87 -27.31 0.51 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.388 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.4 m -81.37 -39.13 25.49 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.64 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.433 HG12 ' CE2' ' A' ' 50' ' ' TRP . 3.7 m -75.3 -52.45 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -177.668 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.427 ' HB ' ' CD1' ' A' ' 4' ' ' PHE . 2.6 mp -80.52 145.57 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.895 0.378 . . . . 0.0 110.969 -179.148 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -136.84 165.97 24.71 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.343 -178.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -105.9 99.28 8.88 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.116 0.484 . . . . 0.0 110.34 179.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.2 t -98.59 95.49 4.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.108 179.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.7 t0 55.35 31.88 17.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.626 0.251 . . . . 0.0 111.559 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.07 28.21 12.29 Favored Glycine 0 C--N 1.329 0.158 0 C-N-CA 120.745 -0.74 . . . . 0.0 113.156 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 74.0 m -140.3 135.09 31.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.757 0.313 . . . . 0.0 110.801 179.776 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 66.6 mt -73.48 121.19 20.16 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.085 -179.652 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -124.78 126.3 45.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.07 0.462 . . . . 0.0 111.572 -179.543 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.463 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 56.0 t80 . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.637 179.837 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.455 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 17.5 p90 . . . . . 0 N--CA 1.465 0.299 0 CA-C-O 120.646 0.26 . . . . 0.0 111.584 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.402 ' CD1' ' CG2' ' A' ' 11' ' ' THR . 8.2 tp -65.45 -14.68 17.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.68 0.276 . . . . 0.0 111.631 -179.447 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -74.91 -24.64 58.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.819 0.342 . . . . 0.0 110.717 179.424 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.4 p -118.65 -2.77 10.91 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.495 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 68.0 m -108.88 150.3 27.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.084 0.469 . . . . 0.0 111.236 -179.526 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.429 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.4 ptm180 -132.18 172.52 12.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.779 -179.861 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.429 ' OD1' ' O ' ' A' ' 9' ' ' ARG . 5.7 p-10 48.71 58.26 5.47 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.908 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.402 ' CG2' ' CD1' ' A' ' 5' ' ' ILE . 42.6 p -79.25 132.15 36.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.75 178.65 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -156.13 163.28 39.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.253 -179.228 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.484 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.8 OUTLIER -97.65 135.7 39.09 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.903 -179.754 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.441 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.54 144.31 48.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.12 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.07 -153.07 31.45 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.764 -1.208 . . . . 0.0 111.321 -178.761 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.55 -37.24 19.83 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -178.243 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.44 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -141.92 36.67 1.59 Allowed 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.201 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.1 mp0 -114.09 144.29 43.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.968 0.413 . . . . 0.0 111.317 178.617 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.408 ' HB2' HD11 ' A' ' 37' ' ' LEU . 13.4 tp -117.33 123.83 47.47 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.672 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.38 142.17 47.44 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.445 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.01 172.22 17.27 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.152 -178.591 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -116.06 133.58 55.87 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.751 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 32.1 m -130.73 134.52 46.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.131 0.491 . . . . 0.0 111.573 -179.104 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.448 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 4.0 ptpt -66.44 137.73 57.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.464 -179.473 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.9 p -85.06 -175.98 5.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.709 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.9 mmt85 -61.97 -30.46 70.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.809 0.337 . . . . 0.0 111.114 -179.811 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.84 9.04 10.73 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 66.77 38.46 3.82 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.292 0.568 . . . . 0.0 111.393 -178.739 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.448 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 13.9 mm100 -116.95 136.76 52.69 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 177.802 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -93.21 124.7 37.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.839 0.352 . . . . 0.0 111.549 -178.753 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.3 m -129.45 149.23 33.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.672 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.8 m -71.63 134.75 46.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.165 0.507 . . . . 0.0 111.523 -178.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.9 t -142.86 161.26 38.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.337 179.744 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -142.57 155.82 45.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.363 0.601 . . . . 0.0 111.848 -179.25 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.1 tp -135.87 127.19 44.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.721 179.349 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -86.89 115.42 24.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.631 0.253 . . . . 0.0 110.946 -178.526 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.7 mp -85.87 -15.97 40.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.457 179.991 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.91 -47.28 74.58 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.366 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.403 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -92.05 -9.83 41.32 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 122.259 -0.275 . . . . 0.0 111.622 179.723 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.437 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 23.8 m-70 -95.69 -67.02 0.87 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.535 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.417 ' CD1' ' CD1' ' A' ' 50' ' ' TRP . 12.9 mm -79.79 148.33 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.486 178.641 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.428 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.03 171.75 13.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.511 -179.753 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.501 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 21.0 t30 -113.16 112.8 24.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.144 -179.158 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.413 ' CD1' ' HB2' ' A' ' 49' ' ' LYS . 2.4 mp -113.25 88.96 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.952 0.406 . . . . 0.0 110.903 179.276 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 43.5 t0 70.89 38.16 1.2 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.075 179.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.72 0.36 89.19 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.161 179.464 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.4 m -110.57 135.71 50.8 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 117.107 0.454 . . . . 0.0 110.943 179.923 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.3 mt -77.61 118.45 20.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.635 0.731 . . . . 0.0 111.508 -178.114 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.413 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 28.4 mttt -137.41 162.75 32.8 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.102 -179.938 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.472 ' CE2' HG11 ' A' ' 90' ' ' VAL . 8.0 m-90 -85.95 119.39 26.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.921 0.391 . . . . 0.0 111.235 -179.648 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.41 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 14.6 tt0 -174.32 148.26 1.28 Allowed Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.344 -179.798 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.41 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 14.2 Cg_exo -66.43 70.28 0.45 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.374 2.049 . . . . 0.0 112.796 -179.061 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.428 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.0 p -162.73 133.67 4.87 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.006 179.026 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -81.19 107.19 13.78 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.991 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.437 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.6 p90 -47.62 -30.84 3.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.479 178.219 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.2 p -47.28 -17.87 0.09 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.874 -179.404 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.1 mm-40 -64.85 -30.75 71.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.648 0.261 . . . . 0.0 111.14 -179.339 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.501 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.7 p -125.86 4.54 7.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.428 179.716 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.5 m -116.84 148.18 41.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.286 0.565 . . . . 0.0 111.992 -178.898 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 43.0 p90 -142.82 157.88 44.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.796 -179.945 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.7 m-20 63.02 45.65 5.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.996 0.427 . . . . 0.0 110.421 -179.097 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 62.9 m -69.96 136.31 50.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.371 179.803 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -140.77 151.23 44.27 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.719 -179.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.484 HG13 ' HB2' ' A' ' 13' ' ' LEU . 26.2 mt -130.32 139.7 50.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-O 121.287 0.565 . . . . 0.0 111.894 -179.901 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -139.36 111.01 7.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.051 178.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.15 -123.12 13.9 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.407 -0.901 . . . . 0.0 111.354 -178.644 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.4 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 22.9 p -102.3 -3.75 26.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.252 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.7 t -101.74 139.85 21.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.987 0.422 . . . . 0.0 111.627 179.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.4 tp -102.2 126.87 49.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.22 179.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.0 m -117.17 125.15 50.75 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.3 t -151.92 153.65 34.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.629 0.252 . . . . 0.0 111.422 -178.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 25.2 m -94.85 126.26 40.06 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.526 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 76.5 m -126.67 145.38 50.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.381 0.61 . . . . 0.0 112.577 -178.555 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -74.61 137.46 42.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.649 178.362 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -93.2 144.82 24.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.763 0.316 . . . . 0.0 110.553 179.63 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 m -52.21 -26.12 10.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.488 -179.44 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -82.89 0.24 45.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.387 179.9 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.06 136.78 7.45 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.833 179.779 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.33 -166.36 12.15 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 -178.68 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -132.3 142.82 49.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.198 0.499 . . . . 0.0 111.299 -179.453 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -153.97 128.8 9.45 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.104 -179.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -92.45 134.82 34.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.652 -179.255 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 60.2 p -122.03 157.99 30.14 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.357 179.755 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.5 m -122.44 145.86 47.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.754 0.312 . . . . 0.0 111.165 -179.804 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.433 HD12 ' CZ3' ' A' ' 50' ' ' TRP . 11.7 tt -144.13 143.39 23.61 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.176 -179.526 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -96.41 113.35 24.92 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.7 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.413 ' O ' HG21 ' A' ' 90' ' ' VAL . 12.9 mt -96.5 -5.47 39.36 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -178.878 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.455 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 14.0 t-20 -44.71 -28.13 0.58 Allowed 'General case' 0 N--CA 1.467 0.417 0 O-C-N 122.111 -0.368 . . . . 0.0 111.936 -178.581 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 71.5 m -82.19 -39.37 23.25 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.896 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.472 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.4 m -72.89 -53.89 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -177.92 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.467 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.2 mp -82.57 147.73 5.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.935 0.397 . . . . 0.0 111.291 -179.066 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.418 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 6.7 tt0 -138.63 166.63 23.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.229 -178.839 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -107.08 99.77 9.3 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.13 0.49 . . . . 0.0 110.68 -179.769 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.415 HG21 ' CD ' ' A' ' 99' ' ' LYS . 39.2 t -98.33 96.83 5.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.035 179.421 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.8 t0 52.98 33.84 15.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.616 0.246 . . . . 0.0 111.535 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.2 28.6 12.91 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.414 179.397 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.6 t -141.24 135.28 30.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.822 0.344 . . . . 0.0 111.015 -179.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.418 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 67.9 mt -74.49 120.11 19.6 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.045 -179.787 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 10.7 mttm -122.47 139.13 54.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.932 -179.966 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.437 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 69.4 t80 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.579 -179.92 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.414 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 18.0 p90 . . . . . 0 N--CA 1.465 0.282 0 CA-C-O 120.603 0.239 . . . . 0.0 111.431 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.408 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 7.0 tp -63.41 -19.95 25.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.737 0.303 . . . . 0.0 111.159 -179.834 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -73.96 -24.01 59.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.676 179.25 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 p -118.58 13.96 13.49 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.445 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 62.1 m -130.76 154.72 47.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.992 0.425 . . . . 0.0 111.066 -179.595 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . 0.406 ' NH2' ' CZ ' ' A' ' 30' ' ' PHE . 15.0 ptp180 -132.99 172.73 12.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.04 -179.812 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.427 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.4 p-10 48.51 57.22 6.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.164 179.688 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.9 p -79.24 133.48 36.67 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.255 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -157.9 163.77 37.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.417 -179.013 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.425 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.43 135.12 39.76 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.949 -179.873 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.42 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.1 144.98 46.31 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 178.796 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.96 -153.24 30.68 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 119.726 -1.226 . . . . 0.0 111.504 -178.955 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.4 -36.57 19.07 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.351 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.82 35.67 1.78 Allowed 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.804 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 10.7 mp0 -115.95 148.91 39.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.092 0.472 . . . . 0.0 111.985 178.892 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.4 ' HB2' ' CD1' ' A' ' 64' ' ' ILE . 15.4 tp -123.79 124.61 43.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.173 179.012 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.26 143.27 46.7 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.68 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.36 172.63 16.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.463 -178.438 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -113.53 133.51 55.21 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 177.532 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 63.3 m -131.03 134.76 46.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.117 0.484 . . . . 0.0 111.962 -179.082 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -67.27 136.49 55.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.526 -179.613 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.4 p -86.29 -178.9 6.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.521 179.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -60.29 -29.22 68.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.785 0.326 . . . . 0.0 110.957 -179.712 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.75 8.53 9.81 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.798 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 66.66 38.13 4.1 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.324 0.583 . . . . 0.0 111.086 -178.692 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.415 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 9.9 mt-30 -119.8 135.57 54.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.039 178.376 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.406 ' CZ ' ' NH2' ' A' ' 9' ' ' ARG . 50.3 m-85 -92.77 124.73 36.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.963 0.411 . . . . 0.0 111.35 -178.981 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.4 m -128.64 151.02 34.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.91 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.4 p -70.95 133.01 46.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.168 0.509 . . . . 0.0 111.835 -178.555 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.2 t -143.4 161.42 38.42 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.323 179.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -143.77 155.28 44.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.231 0.539 . . . . 0.0 111.904 -178.936 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.1 tp -135.44 126.36 44.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.274 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -87.2 117.23 25.81 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.709 0.29 . . . . 0.0 111.136 -178.337 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.408 ' O ' ' N ' ' A' ' 41' ' ' ILE . 3.9 mp -87.74 -15.59 36.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.986 -179.623 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -58.24 -43.5 87.85 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.39 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 4.0 m-20 -91.97 -10.08 40.65 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.024 -0.423 . . . . 0.0 111.195 179.084 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.501 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 25.8 m-70 -96.74 -63.06 1.17 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.633 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.449 HD11 ' CD1' ' A' ' 50' ' ' TRP . 24.1 mm -80.59 149.87 4.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.547 178.443 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.422 ' HB1' ' HB2' ' A' ' 51' ' ' GLN . . . -140.0 172.05 13.32 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.398 -179.773 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.439 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 32.4 t30 -112.7 107.8 16.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.017 -179.021 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 48.0 mm -109.81 91.07 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.182 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.7 t70 66.25 39.58 4.1 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.005 -179.822 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 81.39 1.18 89.97 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.729 179.889 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 m -108.56 137.74 46.01 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.912 0.387 . . . . 0.0 111.253 -179.883 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.4 mt -77.19 115.82 17.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.592 0.711 . . . . 0.0 111.341 -178.151 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -137.71 162.83 32.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.201 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.449 ' CD1' HD11 ' A' ' 41' ' ' ILE . 5.8 m-90 -86.67 122.38 30.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.892 0.377 . . . . 0.0 111.717 -179.35 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.422 ' HB2' ' HB1' ' A' ' 42' ' ' ALA . 1.8 mt-30 -172.14 149.52 2.21 Favored Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.133 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.416 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 53.7 Cg_endo -71.66 64.85 3.07 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 121.932 1.754 . . . . 0.0 112.353 -179.811 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.61 134.09 9.74 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.174 179.02 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.422 ' N ' ' OD1' ' A' ' 54' ' ' ASN . 0.2 OUTLIER -81.04 110.13 16.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.509 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.403 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 47.9 p90 -49.25 -30.31 7.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.88 178.529 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.4 p -49.33 -18.15 0.34 Allowed 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -179.025 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -62.21 -28.07 69.43 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.889 -0.324 . . . . 0.0 111.17 -179.104 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.439 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -128.73 -1.89 5.38 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 179.703 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.8 m -108.72 149.43 29.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.125 0.488 . . . . 0.0 112.083 -178.594 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.2 p90 -141.52 157.26 45.35 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.301 179.903 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 64.14 47.68 3.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.84 -179.197 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.406 ' CB ' HD23 ' A' ' 13' ' ' LEU . 55.8 m -70.1 135.38 49.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.788 179.73 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.29 152.32 42.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.714 -179.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.425 HG13 ' HB2' ' A' ' 13' ' ' LEU . 45.7 mt -130.96 140.33 48.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.253 0.549 . . . . 0.0 111.974 -179.724 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -136.26 109.77 7.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.274 179.208 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.47 -119.82 13.6 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.303 -0.951 . . . . 0.0 110.939 -178.457 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.8 p -102.34 -3.29 27.36 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.464 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 t -101.9 136.97 31.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.022 0.439 . . . . 0.0 111.811 179.975 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.3 tp -101.8 125.48 48.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.301 179.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.7 m -115.46 126.36 54.23 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -179.859 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.5 t -151.77 153.54 34.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.792 0.33 . . . . 0.0 111.649 -178.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.6 m -95.42 126.02 40.43 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.812 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.9 m -126.19 144.5 50.74 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.598 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -74.31 137.64 43.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.375 178.037 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.2 mtm-85 -91.94 142.37 27.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.668 0.27 . . . . 0.0 110.593 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.2 m -52.21 -27.0 13.03 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.612 -179.361 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -83.05 1.98 37.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.706 0.289 . . . . 0.0 111.393 179.924 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.49 134.07 6.53 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.497 -179.873 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.11 -171.07 13.58 Favored Glycine 0 C--N 1.318 -0.459 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.625 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -132.19 144.19 50.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 117.28 0.54 . . . . 0.0 111.337 -179.905 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -154.39 132.29 11.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.245 179.879 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -94.45 134.44 36.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.306 -179.642 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.3 p -120.61 158.28 27.72 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.283 179.711 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.07 144.33 48.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.26 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 13.4 tt -144.51 143.83 22.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.693 179.913 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -98.0 118.31 34.32 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.942 179.524 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.8 mt -100.32 -6.05 26.45 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -179.06 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.408 ' ND2' ' CG2' ' A' ' 5' ' ' ILE . 14.1 t-20 -44.63 -28.25 0.58 Allowed 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -178.349 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 13.2 m -82.2 -39.53 22.99 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.44 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.2 m -72.32 -52.62 23.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 N-CA-C 113.445 0.905 . . . . 0.0 113.445 -177.943 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.44 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -81.55 147.3 6.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.131 0.491 . . . . 0.0 111.238 -179.17 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.439 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 15.3 tt0 -137.62 165.63 25.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.061 -178.617 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -107.63 100.16 9.58 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.235 0.54 . . . . 0.0 110.728 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.2 t -98.34 98.44 7.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.78 179.039 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.8 t0 54.17 32.55 16.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.672 0.272 . . . . 0.0 111.41 -179.801 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.49 28.46 11.41 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.316 179.297 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.1 m -140.38 137.35 33.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.918 0.39 . . . . 0.0 111.571 -179.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.439 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 57.0 mt -74.38 119.04 18.04 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.686 179.873 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.428 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.5 mttm -126.57 145.35 50.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.671 -179.112 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.501 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.023 179.406 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.408 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 13.2 p90 . . . . . 0 N--CA 1.467 0.42 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.5 tp -62.64 -19.14 22.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.601 0.239 . . . . 0.0 111.544 -179.467 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -74.38 -25.64 59.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.615 0.245 . . . . 0.0 111.037 179.293 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.1 p -118.91 -0.94 11.09 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.641 179.287 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 80.6 m -109.84 151.42 27.03 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.898 0.38 . . . . 0.0 111.279 -179.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.1 172.24 12.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.015 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 48.88 58.76 4.98 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -179.871 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 p -79.25 134.07 36.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.84 178.622 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -157.26 163.65 38.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.507 -179.183 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.402 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.7 OUTLIER -97.66 135.42 39.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.097 -179.869 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -118.61 144.17 46.31 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 178.657 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.81 -152.11 32.3 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 119.753 -1.213 . . . . 0.0 111.566 -179.01 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.99 -36.64 18.14 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.413 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.403 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.1 p -140.73 34.87 1.79 Allowed 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -178.588 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -115.36 148.54 39.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.106 0.479 . . . . 0.0 112.06 178.788 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.6 tp -122.31 123.76 42.17 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.46 179.504 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.07 143.97 47.84 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.901 0.381 . . . . 0.0 110.031 179.405 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.6 172.56 16.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.876 -178.539 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -112.56 133.57 54.55 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 176.893 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 58.4 m -130.59 133.57 46.29 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.51 -0.476 . . . . 0.0 112.026 -178.924 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.7 ptpt -66.03 136.95 56.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.664 -179.78 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 63.7 p -85.98 -176.92 6.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.566 179.872 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -61.52 -29.72 70.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.674 0.273 . . . . 0.0 111.183 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.0 8.39 10.71 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.622 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 66.26 38.08 4.69 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.216 0.531 . . . . 0.0 111.196 -178.725 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -118.58 135.83 54.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.664 178.307 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -92.88 124.53 36.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.061 0.458 . . . . 0.0 111.786 -178.518 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.7 m -130.3 151.29 35.65 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.723 -179.983 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.4 t -72.44 136.46 46.01 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.166 0.508 . . . . 0.0 112.079 -178.723 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 t -145.13 161.72 38.8 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.265 179.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt -143.1 157.19 44.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.48 0.657 . . . . 0.0 112.177 -179.215 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -136.74 125.6 36.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.922 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -88.32 119.56 28.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.621 0.248 . . . . 0.0 110.977 -177.93 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 17' ' ' SER . 3.9 mp -88.94 -14.88 35.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.488 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.2 p-10 -57.4 -45.61 84.35 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.222 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.436 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 3.8 p30 -92.83 -10.48 36.64 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.906 -0.496 . . . . 0.0 111.377 178.567 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.47 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 9.5 m-70 -94.29 -66.07 0.94 Allowed 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.959 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.443 ' N ' ' CD1' ' A' ' 41' ' ' ILE . 1.6 mp -81.24 150.64 4.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.938 178.809 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.41 ' HB1' ' HB2' ' A' ' 51' ' ' GLN . . . -140.98 171.68 13.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.808 -179.032 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.404 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 23.7 t30 -113.25 111.52 22.18 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.367 -179.202 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.4 mp -112.45 89.32 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-O 120.918 0.389 . . . . 0.0 111.161 179.731 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t0 67.32 38.13 3.37 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.937 179.369 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.54 0.85 87.98 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.473 -0.87 . . . . 0.0 113.158 179.307 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.1 m -112.94 136.48 52.56 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.193 0.496 . . . . 0.0 110.842 179.776 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.9 mt -77.38 117.97 19.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.649 0.738 . . . . 0.0 112.541 -177.521 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.6 mttt -139.61 163.01 33.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.545 179.475 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.436 ' CZ2' HD13 ' A' ' 85' ' ' ILE . 9.5 m-90 -87.7 127.08 35.3 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.892 0.331 . . . . 0.0 111.892 -179.4 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.41 ' HB2' ' HB1' ' A' ' 42' ' ' ALA . 0.1 OUTLIER -172.92 159.14 3.57 Favored Pre-proline 0 N--CA 1.468 0.432 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.686 -179.785 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -77.02 61.55 7.21 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 122.118 1.879 . . . . 0.0 112.142 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.1 p -156.47 135.34 11.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.85 -1.068 . . . . 0.0 108.599 179.193 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.29 109.87 16.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.227 0.536 . . . . 0.0 112.139 -178.182 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -46.41 -30.02 1.96 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.087 178.764 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.6 p -50.65 -17.11 0.47 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -179.049 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -61.2 -29.37 69.77 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.838 -179.308 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.404 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.3 p -129.68 0.63 4.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.531 179.249 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.9 m -110.86 148.3 32.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.3 0.572 . . . . 0.0 112.06 -178.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -141.72 157.53 44.94 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.021 -179.682 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 63.71 45.62 4.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.912 0.387 . . . . 0.0 110.879 -179.356 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.1 m -69.01 137.2 53.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.513 179.655 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.58 152.13 41.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.071 -179.433 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.402 HG13 ' HB2' ' A' ' 13' ' ' LEU . 39.9 mt -131.01 140.27 49.05 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 121.302 0.573 . . . . 0.0 112.239 -179.898 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -137.88 110.68 7.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.273 179.271 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.66 -121.71 17.95 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.368 -0.92 . . . . 0.0 111.171 -178.602 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.1 p -100.49 -2.92 31.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.984 0.392 . . . . 0.0 112.002 -179.408 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.4 t -103.57 138.41 28.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -179.633 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.7 tp -102.85 124.64 48.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.615 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.7 m -115.52 126.65 54.54 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -179.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.2 t -151.89 153.8 34.87 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.128 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 8.3 m -95.06 126.42 40.39 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 178.814 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 73.4 m -127.32 146.3 50.49 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -178.266 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -75.82 137.29 40.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.631 178.042 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 47.8 mtm-85 -92.06 146.04 24.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.743 0.306 . . . . 0.0 110.601 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.1 m -51.92 -31.41 28.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.851 -179.169 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -81.74 2.82 28.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.619 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.19 136.27 6.83 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.34 -179.82 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.0 -173.46 14.71 Favored Glycine 0 C--N 1.317 -0.498 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 -178.41 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -131.65 143.24 50.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.398 0.599 . . . . 0.0 111.484 -179.798 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -154.44 130.81 10.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.38 179.563 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 0.9 OUTLIER -92.46 134.28 35.1 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.157 -179.763 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.6 p -119.72 158.65 26.06 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.383 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.47 144.66 48.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.338 -179.52 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.436 HD13 ' CZ2' ' A' ' 50' ' ' TRP . 11.8 tt -146.97 145.01 19.71 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.577 179.728 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -98.25 118.7 35.47 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.648 179.502 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 7.0 mt -99.72 -6.46 27.07 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -178.738 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -45.06 -28.61 0.73 Allowed 'General case' 0 N--CA 1.468 0.442 0 O-C-N 122.17 -0.331 . . . . 0.0 111.825 -178.532 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 7.5 m -80.35 -39.61 28.22 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.447 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.0 m -73.5 -52.58 20.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -178.367 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.447 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.1 mp -81.75 147.32 6.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.927 0.394 . . . . 0.0 111.235 -179.174 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -137.16 165.42 26.14 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.179 -178.709 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -106.4 99.83 9.39 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.133 0.492 . . . . 0.0 110.708 -179.651 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.7 t -99.26 96.75 5.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.171 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.8 t0 52.7 33.37 13.74 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 179.742 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.23 28.43 11.72 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.748 -0.739 . . . . 0.0 113.206 179.235 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.0 t -141.63 134.31 28.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.779 0.323 . . . . 0.0 111.174 -179.831 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.8 mt -74.75 120.34 20.16 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.054 0.454 . . . . 0.0 110.88 179.923 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -123.3 138.97 54.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.281 -179.71 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.47 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 36.2 t80 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.476 179.518 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.449 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 22.7 p90 . . . . . 0 N--CA 1.464 0.235 0 CA-C-O 120.585 0.231 . . . . 0.0 111.289 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.429 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 6.4 tp -64.46 -16.32 19.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.714 0.292 . . . . 0.0 111.397 -179.871 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -76.04 -24.95 55.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.817 0.342 . . . . 0.0 110.802 179.36 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.4 p -118.29 -4.04 10.96 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.656 179.775 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 60.4 m -109.69 153.64 23.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.161 0.505 . . . . 0.0 111.067 -179.557 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 22.2 ptt180 -132.27 173.03 11.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.615 -179.948 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.402 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.9 p-10 49.12 58.01 5.85 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.011 0.434 . . . . 0.0 112.027 179.867 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.1 p -79.31 130.02 35.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.952 178.801 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -156.15 163.15 39.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.38 -179.403 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.488 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.64 136.57 37.82 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.467 179.901 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -121.03 144.6 48.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.071 179.273 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.21 -152.09 29.86 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 119.85 -1.167 . . . . 0.0 111.36 -178.759 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.16 -37.07 19.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.098 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.426 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.34 36.59 1.69 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.92 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 3.2 mp0 -115.71 145.74 42.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.15 0.5 . . . . 0.0 111.512 178.922 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.404 ' HB2' HD12 ' A' ' 37' ' ' LEU . 13.3 tp -119.92 123.79 44.42 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 178.913 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.29 142.89 46.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.876 0.369 . . . . 0.0 110.041 179.595 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.22 172.28 16.96 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.001 -178.795 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -114.39 133.55 55.63 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.69 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 39.4 m -130.61 133.38 46.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.134 0.492 . . . . 0.0 111.709 -179.12 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 3.1 ptpt -66.59 137.99 57.15 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.451 -179.624 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 21.1 p -85.48 -177.13 6.36 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.637 179.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.4 mtt-85 -61.33 -30.35 70.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.298 -179.673 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.77 9.46 9.7 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -179.099 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 66.84 38.34 3.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.223 0.535 . . . . 0.0 111.609 -178.838 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.489 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 16.0 mm100 -116.8 137.68 52.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.811 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -94.65 124.77 38.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.896 0.379 . . . . 0.0 111.883 -178.778 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 23.5 m -130.47 151.47 35.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.914 179.543 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.3 m -72.45 134.87 45.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.223 0.535 . . . . 0.0 111.617 -178.842 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.2 t -141.75 161.51 37.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.002 179.713 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -140.74 154.14 46.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.462 0.649 . . . . 0.0 112.007 -178.895 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -138.36 122.58 21.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.0 -1.0 . . . . 0.0 108.61 179.214 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -86.57 119.14 26.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.824 0.345 . . . . 0.0 110.863 -178.646 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 17' ' ' SER . 4.4 mp -87.0 -15.56 38.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.757 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.447 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -57.49 -45.92 84.31 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.024 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.447 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.3 m-20 -92.13 -10.04 40.33 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 122.101 -0.375 . . . . 0.0 111.53 179.599 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 39.4 m-70 -98.63 -67.45 0.85 Allowed 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.799 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.3 mp -81.13 149.71 4.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.407 178.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.417 ' HB1' ' CG ' ' A' ' 51' ' ' GLN . . . -141.4 172.57 12.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.148 -179.37 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.482 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 12.9 t30 -112.45 114.68 27.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.98 179.682 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 49.7 mm -113.41 89.35 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.384 -179.641 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 56.8 t0 71.12 38.53 1.08 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.95 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.41 0.68 88.25 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.889 179.779 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.9 m -115.2 136.29 53.26 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.917 0.389 . . . . 0.0 110.814 179.793 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.6 mt -77.5 120.26 22.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.516 0.674 . . . . 0.0 111.545 -178.16 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -135.37 162.06 33.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.873 179.877 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.45 ' CZ3' HD12 ' A' ' 85' ' ' ILE . 8.0 m-90 -89.2 117.61 28.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.061 0.458 . . . . 0.0 112.193 -179.065 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.417 ' CG ' ' HB1' ' A' ' 42' ' ' ALA . 3.0 pt20 -178.55 151.12 0.72 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.974 178.656 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.426 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 28.4 Cg_endo -63.21 81.98 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.263 1.975 . . . . 0.0 113.118 -178.697 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.414 ' OG ' ' CB ' ' A' ' 42' ' ' ALA . 3.0 p -172.38 131.92 0.61 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.018 178.938 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.81 108.87 15.69 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -177.921 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.426 ' CZ ' ' CB ' ' A' ' 17' ' ' SER . 25.1 p90 -47.91 -29.77 3.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.469 178.544 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.7 p -48.8 -15.92 0.11 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.217 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -64.63 -30.79 71.82 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.599 -178.79 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.482 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -129.75 2.81 4.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.504 0.192 . . . . 0.0 111.301 179.763 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.6 m -112.2 148.03 34.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.207 0.527 . . . . 0.0 111.827 -179.013 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -142.48 157.37 44.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.017 -179.724 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 63.33 47.61 3.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.961 0.41 . . . . 0.0 110.693 -179.187 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.1 m -70.11 136.36 50.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.598 179.865 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.04 152.09 43.04 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.494 179.791 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.488 HG13 ' HB2' ' A' ' 13' ' ' LEU . 34.6 mt -130.28 140.6 48.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.219 0.533 . . . . 0.0 111.649 -179.933 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -137.44 110.6 7.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.236 -0.893 . . . . 0.0 108.99 179.059 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.68 -122.33 16.9 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.24 -0.981 . . . . 0.0 111.179 -178.651 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.402 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 20.8 p -101.18 -4.33 27.43 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -179.521 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.5 t -101.74 139.56 22.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.969 0.414 . . . . 0.0 111.691 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.0 tp -102.22 127.82 49.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.356 179.834 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.8 m -117.24 124.34 48.82 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.902 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.6 t -151.26 153.32 34.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.686 -0.233 . . . . 0.0 111.159 -178.881 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.9 m -93.14 125.96 38.0 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.015 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.3 m -127.14 144.34 51.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.316 0.579 . . . . 0.0 112.52 -178.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -74.84 138.1 42.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.857 178.454 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 59.5 mtp180 -92.65 143.55 26.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.66 0.267 . . . . 0.0 110.53 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.2 m -51.83 -25.63 8.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.565 -0.288 . . . . 0.0 111.448 -179.429 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -82.79 0.84 41.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.762 0.315 . . . . 0.0 111.442 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.36 135.86 6.73 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.437 -179.935 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.55 -168.49 12.76 Favored Glycine 0 C--N 1.319 -0.386 0 N-CA-C 111.298 -0.721 . . . . 0.0 111.298 -178.742 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -131.19 141.63 50.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 117.145 0.473 . . . . 0.0 111.246 -179.626 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -154.28 130.71 10.54 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.26 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -93.35 134.37 35.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.303 -179.478 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 p -120.9 158.47 27.59 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.902 0.382 . . . . 0.0 110.542 179.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 60.5 p -120.6 143.74 48.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.45 HD12 ' CZ3' ' A' ' 50' ' ' TRP . 14.4 tt -144.51 142.07 23.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.382 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -96.31 116.6 29.28 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.213 179.876 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.432 ' O ' HG23 ' A' ' 90' ' ' VAL . 10.0 mt -96.64 -6.64 36.18 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -179.025 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.449 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 12.1 t-20 -44.99 -29.48 0.84 Allowed 'General case' 0 N--CA 1.466 0.355 0 O-C-N 122.186 -0.322 . . . . 0.0 111.705 -178.652 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.75 -41.0 24.24 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.947 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.467 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.2 m -71.01 -53.19 22.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 113.358 0.874 . . . . 0.0 113.358 -177.91 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.467 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.81 147.79 5.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.992 0.425 . . . . 0.0 111.568 -178.836 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 13.4 tt0 -137.02 165.66 25.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.866 -179.074 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -107.57 99.71 9.19 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.112 0.482 . . . . 0.0 110.25 179.837 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . 0.41 HG22 ' CG ' ' A' ' 99' ' ' LYS . 38.9 t -98.81 96.69 5.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.136 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.8 t0 52.75 33.99 15.23 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.716 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.5 28.07 12.05 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.845 -0.693 . . . . 0.0 113.389 179.155 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.1 t -141.89 135.46 29.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.789 0.328 . . . . 0.0 111.401 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.407 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 64.3 mt -73.59 119.26 17.57 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.425 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.41 ' CG ' HG22 ' A' ' 94' ' ' VAL . 8.0 mttm -125.29 148.63 48.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.647 -178.995 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.9 t80 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.902 -179.841 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 15.8 p90 . . . . . 0 N--CA 1.464 0.262 0 CA-C-O 120.597 0.237 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.404 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 3.9 tp -66.06 -13.64 16.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.727 0.299 . . . . 0.0 111.101 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -77.34 -27.36 52.74 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.016 0.436 . . . . 0.0 109.874 178.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 42.6 p -118.74 11.22 12.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.138 178.755 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.7 m -124.94 149.88 47.18 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.153 0.501 . . . . 0.0 111.616 -179.043 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -133.64 173.0 11.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.797 179.764 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 p30 49.99 56.91 7.16 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.792 0.437 . . . . 0.0 112.07 -179.743 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.402 ' CG2' ' CD1' ' A' ' 5' ' ' ILE . 25.0 p -79.27 133.8 36.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.898 178.588 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -157.09 163.68 38.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.571 -179.166 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.461 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.7 OUTLIER -97.7 136.08 38.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.905 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.92 144.31 48.51 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.1 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.67 -152.92 34.07 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 119.866 -1.159 . . . . 0.0 111.281 -178.859 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.57 -37.05 20.02 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.427 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -142.09 35.61 1.54 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -179.085 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 2.1 mp0 -113.28 147.27 37.91 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.959 0.409 . . . . 0.0 111.511 178.604 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.401 ' HB2' HD11 ' A' ' 37' ' ' LEU . 11.9 tp -119.65 124.79 47.14 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.983 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.01 143.32 49.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.531 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.65 172.64 15.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.187 -178.795 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -111.2 133.85 53.23 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.044 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.3 m -130.82 133.98 46.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.124 0.488 . . . . 0.0 111.881 -179.089 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.421 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 8.3 ptpt -66.03 136.79 56.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.382 -179.606 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.8 p -85.45 -176.29 6.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.52 179.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 39.4 mtm180 -61.54 -30.68 70.8 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.642 0.258 . . . . 0.0 111.316 -179.615 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.86 9.89 10.97 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.097 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 66.57 39.45 3.75 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.263 0.554 . . . . 0.0 111.614 -178.795 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.421 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 50.0 mt-30 -117.12 136.44 53.0 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.565 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -92.56 124.33 36.51 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.614 -178.688 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.6 m -128.89 149.08 33.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.354 179.448 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.7 m -72.36 136.7 46.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.269 0.557 . . . . 0.0 111.616 -178.847 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -142.17 161.21 38.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.148 179.668 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.9 154.22 47.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.394 0.616 . . . . 0.0 112.012 -179.379 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -136.89 126.43 37.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.096 -0.957 . . . . 0.0 108.858 179.656 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -87.94 115.52 25.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.609 0.243 . . . . 0.0 111.622 -178.032 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 17' ' ' SER . 3.8 mp -87.03 -16.33 35.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.22 179.359 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.66 -45.13 81.86 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.691 0.281 . . . . 0.0 111.399 -178.863 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.413 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -92.05 -10.49 38.95 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 122.241 -0.287 . . . . 0.0 111.617 179.633 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' HIS . . . . . 0.487 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 17.7 m-70 -97.43 -64.47 1.04 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.441 HD11 ' CD1' ' A' ' 50' ' ' TRP . 29.8 mm -79.77 148.05 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.645 179.026 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -140.01 172.04 13.33 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.603 -179.775 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.449 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 32.9 t30 -113.02 111.23 21.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.378 -178.939 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.418 ' N ' ' CD1' ' A' ' 44' ' ' ILE . 2.2 mp -111.21 89.49 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.915 179.289 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.1 t70 67.95 38.14 2.87 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.105 -179.958 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.71 2.39 88.71 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.627 -0.797 . . . . 0.0 113.231 179.448 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.2 m -111.5 136.32 50.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.201 0.501 . . . . 0.0 111.162 -179.946 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.1 mt -77.5 117.47 18.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.616 0.722 . . . . 0.0 111.384 -178.199 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.41 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 8.9 mttm -138.45 163.01 33.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.128 -179.841 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' TRP . . . . . 0.441 ' CD1' HD11 ' A' ' 41' ' ' ILE . 7.3 m-90 -85.91 119.82 26.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.991 0.424 . . . . 0.0 111.493 -179.464 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.456 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 40.5 tt0 -174.99 143.52 0.77 Allowed Pre-proline 0 N--CA 1.463 0.221 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.359 -179.983 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.456 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 29.6 Cg_endo -64.68 72.09 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 122.289 1.993 . . . . 0.0 112.868 -179.171 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.411 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.9 p -163.44 133.8 4.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.4 178.932 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.47 ' N ' ' OD1' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.41 109.88 15.33 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.682 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.421 ' CD1' ' N ' ' A' ' 56' ' ' SER . 12.7 p90 -50.09 -30.47 11.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.721 178.522 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.421 ' N ' ' CD1' ' A' ' 55' ' ' PHE . 77.3 p -48.4 -19.63 0.33 Allowed 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -179.196 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -60.49 -26.29 66.71 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.944 -0.302 . . . . 0.0 111.073 -179.096 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.449 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -132.08 0.29 3.8 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.501 179.204 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.3 m -110.95 148.35 32.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.159 0.504 . . . . 0.0 111.912 -178.75 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -143.47 157.79 44.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.081 -179.739 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 64.6 45.46 3.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.922 0.391 . . . . 0.0 110.884 -179.41 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 68.1 m -69.54 136.29 51.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.777 179.893 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.24 150.51 42.73 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.318 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.461 HG13 ' HB2' ' A' ' 13' ' ' LEU . 35.2 mt -129.13 138.98 53.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.301 0.572 . . . . 0.0 111.631 179.93 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -136.27 110.22 8.22 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.374 179.265 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.85 -121.09 13.58 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.403 -0.903 . . . . 0.0 110.982 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 26.9 p -101.85 -5.7 24.47 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -179.259 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 t -101.03 141.28 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.075 0.465 . . . . 0.0 111.773 179.693 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.4 tp -103.96 126.63 51.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.565 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.5 m -116.05 125.88 53.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.325 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.3 t -151.7 153.83 35.14 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.625 0.25 . . . . 0.0 111.336 -179.294 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.2 m -94.08 125.95 39.02 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.651 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 93.0 m -124.53 142.89 51.0 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -178.41 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -73.14 137.06 44.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.657 178.42 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -92.29 142.42 27.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.632 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 m -52.05 -29.23 20.37 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.476 -179.499 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -82.45 1.27 38.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.45 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.35 135.81 7.61 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.99 179.646 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.07 -169.89 13.14 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -131.27 142.66 50.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.32 0.56 . . . . 0.0 111.142 -179.899 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -153.84 128.18 9.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.029 -179.697 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 5.2 t -92.64 134.96 34.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.685 -179.028 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 64.1 p -121.33 158.38 28.35 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.375 179.954 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.0 m -122.83 144.81 48.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.976 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.0 tt -144.91 142.83 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.815 -179.818 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -95.3 115.46 27.46 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.93 179.597 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.409 ' O ' HG23 ' A' ' 90' ' ' VAL . 14.9 mt -97.01 -5.29 38.06 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -179.343 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . 0.404 ' ND2' ' CG2' ' A' ' 5' ' ' ILE . 9.0 t-20 -44.42 -28.95 0.62 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.447 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 64.5 m -82.23 -38.07 25.05 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.749 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 90' ' ' VAL . . . . . 0.448 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.1 m -74.09 -52.96 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -177.996 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.448 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.59 146.41 7.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.032 0.444 . . . . 0.0 111.292 -179.161 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 99' ' ' LYS . 22.1 tt0 -137.38 167.07 22.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.077 -178.851 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -107.18 99.43 8.97 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.131 0.491 . . . . 0.0 110.501 -179.745 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.5 t -97.77 95.88 4.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.826 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.9 t0 54.16 33.8 18.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.659 0.266 . . . . 0.0 111.549 179.939 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.37 28.55 12.76 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.97 179.631 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.5 t -139.82 134.25 31.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.85 0.357 . . . . 0.0 111.187 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.405 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 71.8 mt -73.51 120.09 18.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.57 179.951 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.409 ' O ' ' N ' ' A' ' 92' ' ' GLU . 18.8 mttt -124.93 130.95 53.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.565 -178.927 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 100' ' ' TYR . . . . . 0.487 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 26.3 t80 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.365 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.226 0 N-CA-C 112.573 -0.211 . . . . 4.3399999999999999 112.573 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.407 ' O ' ' O ' ' A' ' 89' ' ' SER . 2.8 tp -144.73 30.52 1.2 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.847 0.356 . . . . 3.0800000000000001 110.956 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 143.84 -98.54 0.21 Allowed Glycine 0 C--N 1.329 0.175 0 N-CA-C 111.434 -0.666 . . . . 1.6299999999999999 111.434 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.504 ' HA ' ' ND2' ' A' ' 88' ' ' ASN . 71.6 mttt 65.95 80.57 0.22 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.034 0.445 . . . . 2.2400000000000002 111.68 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -92.25 -36.58 13.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.66 -0.7 . . . . 0.31 110.661 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.511 ' HB ' ' HB3' ' A' ' 67' ' ' SER . 2.2 tp -63.03 -19.42 23.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 1.0600000000000001 111.569 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -75.65 -27.25 58.3 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.904 -0.318 . . . . 2.0099999999999998 111.151 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 50.6 p -118.78 14.11 13.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.519 -0.31 . . . . 1.0700000000000001 111.501 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.2 m -129.67 151.32 50.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.067 0.461 . . . . 0.28999999999999998 111.353 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.62 172.83 12.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.715 -0.675 . . . . 3.0099999999999998 110.723 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.44 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 4.9 p-10 49.16 56.05 8.38 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.211 -0.45 . . . . 1.74 111.875 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.1 p -79.19 134.1 36.69 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.733 -0.469 . . . . 1.02 109.733 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -157.26 163.41 38.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.125 -0.489 . . . . 1.9399999999999999 111.511 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.535 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.5 OUTLIER -97.35 136.56 37.65 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.713 -0.676 . . . . 1.02 110.958 -179.664 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.565 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.1 146.29 46.08 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.319 -0.855 . . . . 1.03 109.324 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.21 -152.64 24.5 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.002 -1.094 . . . . 0.12 111.438 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.52 -36.41 18.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.014 0.407 . . . . 0.83999999999999997 111.352 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.523 ' OG ' ' HB3' ' A' ' 38' ' ' ASP . 8.0 p -144.71 72.17 1.33 Allowed 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.509 -0.923 . . . . 0.75 108.509 179.357 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.565 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 4.5 mp0 -146.13 141.19 27.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.538 -0.756 . . . . 1.1299999999999999 111.508 176.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.468 ' CB ' HD11 ' A' ' 37' ' ' LEU . 21.2 tp -121.45 120.98 36.52 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.102 -0.703 . . . . 1.02 109.102 177.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.42 144.33 45.1 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.712 -0.477 . . . . 1.02 109.712 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.56 172.51 16.24 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.061 -0.518 . . . . 0.98999999999999999 110.729 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -112.83 133.25 54.91 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.163 -1.051 . . . . 1.5800000000000001 108.163 176.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 59.0 m -131.0 136.39 48.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.228 0.537 . . . . 0.17999999999999999 112.025 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 5.4 ptpt -68.03 135.22 51.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.465 -0.789 . . . . 1.3999999999999999 111.632 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.7 p -87.03 -175.43 5.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.246 -0.888 . . . . 1.04 110.617 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -59.16 -33.73 71.26 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.604 0.594 . . . . 3.5 112.604 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.45 11.67 8.2 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.554 0.576 . . . . 0.93999999999999995 112.554 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 67.09 41.86 2.51 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.589 0.709 . . . . 1.9099999999999999 110.497 -178.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.464 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 11.5 mt-30 -116.68 132.63 56.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.692 -1.14 . . . . 2.0800000000000001 108.513 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 77.4 m-85 -90.66 124.21 34.89 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.495 -0.482 . . . . 1.5700000000000001 110.727 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.7 m -122.29 160.89 23.89 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-O 120.974 0.416 . . . . 1.04 111.584 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.46 126.5 31.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.844 -0.616 . . . . 1.6699999999999999 111.151 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.5 t -140.42 157.46 45.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.327 -0.397 . . . . 1.01 110.779 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -145.9 142.35 28.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.236 0.541 . . . . 2.1099999999999999 112.106 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.43 ' CG2' ' HB3' ' A' ' 19' ' ' LEU . 1.9 tp -118.57 126.62 75.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.367 -0.833 . . . . 1.03 108.77 178.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -87.3 118.64 26.87 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 122.271 -0.268 . . . . 1.5900000000000001 110.672 -178.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.468 HD11 ' CB ' ' A' ' 19' ' ' LEU . 4.7 mp -87.56 -16.05 35.71 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.353 0.501 . . . . 1.03 112.353 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.533 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 23.3 p30 -56.07 -45.38 79.33 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.582 0.586 . . . . 1.8899999999999999 112.582 -177.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.533 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 2.5 p30 -91.37 -10.25 41.87 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 122.261 -0.274 . . . . 1.6599999999999999 111.699 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -97.32 -64.21 1.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.747 -0.464 . . . . 0.28999999999999998 109.747 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.428 HD13 ' CD1' ' A' ' 50' ' ' TRP . 25.6 mm -81.01 151.27 4.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.85 -0.614 . . . . 1.6499999999999999 111.358 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.478 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.15 172.18 13.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.495 -0.775 . . . . 0.98999999999999999 111.327 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.67 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 23.1 t30 -111.34 110.91 21.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.943 -0.571 . . . . 0.17999999999999999 110.614 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.6 mm -110.39 92.34 2.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.947 -0.569 . . . . 1.74 112.004 -179.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 20.4 t0 62.65 37.18 13.06 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.777 0.323 . . . . 1.1299999999999999 111.252 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.26 0.79 88.5 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.612 -0.804 . . . . 0.14000000000000001 112.942 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.5 m -113.18 135.5 53.75 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.982 0.391 . . . . 1.0600000000000001 110.649 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 21.2 mt -77.04 118.72 19.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.604 0.716 . . . . 1.0900000000000001 110.95 -178.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -137.15 162.51 33.23 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 114.654 -1.157 . . . . 1.9199999999999999 110.042 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.476 ' CE2' HG12 ' A' ' 90' ' ' VAL . 9.7 m-90 -85.54 119.15 25.57 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.999 0.428 . . . . 0.28999999999999998 111.466 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -174.9 141.22 0.69 Allowed Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.829 -0.623 . . . . 1.95 110.131 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -66.07 70.18 0.4 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.195 1.93 . . . . 0.70999999999999996 112.979 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.478 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.0 p -155.08 137.32 14.83 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.831 -1.077 . . . . 0.68000000000000005 108.154 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.406 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.5 OUTLIER -80.95 104.2 11.3 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.097 0.777 . . . . 1.02 113.097 -176.806 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.498 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 44.2 p90 -51.9 -36.59 49.35 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.195 -0.911 . . . . 0.89000000000000001 110.108 177.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 77.5 p -45.82 -25.1 0.46 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 114.938 -1.028 . . . . 0.79000000000000004 112.939 -178.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -66.27 -20.24 66.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.676 0.275 . . . . 1.99 111.352 -179.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.67 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 30.1 p -128.69 6.71 5.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.485 -0.325 . . . . 1.05 111.007 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.2 m -126.45 149.67 49.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.209 0.528 . . . . 0.11 111.703 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.3 p90 -142.42 157.86 44.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.319 -0.855 . . . . 1.6599999999999999 109.817 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 54.1 m-20 63.38 46.65 4.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.096 0.474 . . . . 1.55 110.639 -179.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 46.1 m -69.37 135.11 49.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.847 -0.615 . . . . 0.76000000000000001 110.178 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.437 ' O ' HD11 ' A' ' 69' ' ' LEU . . . -141.96 150.04 40.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.493 . . . . 1.04 111.703 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.535 HG13 ' HB2' ' A' ' 13' ' ' LEU . 38.6 mt -130.45 142.44 43.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.222 0.534 . . . . 1.04 111.86 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -139.64 111.93 7.64 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.253 -0.885 . . . . 2.1800000000000002 108.847 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.75 -122.97 21.32 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.242 -0.98 . . . . 0.13 111.58 -178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.511 ' HB3' ' HB ' ' A' ' 5' ' ' ILE . 82.5 p -100.36 -5.64 26.99 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.492 0.553 . . . . 0.73999999999999999 112.492 -178.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.6 t -102.8 139.87 22.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 121.052 0.453 . . . . 1.04 111.692 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.437 HD11 ' O ' ' A' ' 63' ' ' ALA . 7.1 tp -102.25 126.95 49.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.824 -0.625 . . . . 0.98999999999999999 110.89 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.428 ' N ' HD11 ' A' ' 69' ' ' LEU . 4.5 m -116.04 123.99 49.32 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.962 -0.385 . . . . 1.05 109.962 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 82' ' ' THR . 11.2 t -151.54 153.38 34.43 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.253 -0.179 . . . . 0.81999999999999995 111.245 -178.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.557 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 15.6 m -95.72 126.47 41.01 Favored 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 109.832 -0.433 . . . . 1.04 109.832 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.424 ' HB3' ' OD1' ' A' ' 43' ' ' ASN . 72.3 m -126.87 145.85 50.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.361 0.6 . . . . 0.10000000000000001 112.17 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -74.96 139.08 42.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.167 -0.924 . . . . 1.26 111.113 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -91.32 145.0 25.01 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.915 -0.402 . . . . 3.9100000000000001 109.915 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 34.9 m -51.46 -32.1 25.74 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.466 0.543 . . . . 1.0700000000000001 112.466 -178.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -83.58 4.6 27.52 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.04 0.385 . . . . 1.97 112.04 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.15 136.94 8.02 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.668 -0.777 . . . . 0.16 113.106 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 119.55 -174.58 15.52 Favored Glycine 0 N--CA 1.451 -0.337 0 N-CA-C 110.94 -0.864 . . . . 0.17999999999999999 110.94 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -130.63 140.88 50.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.383 0.592 . . . . 1.26 111.032 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -154.16 131.04 10.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.139 -0.482 . . . . 1.8799999999999999 110.421 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.557 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.3 t -93.71 134.67 35.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.98999999999999999 111.118 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 53.1 p -120.19 158.03 27.83 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.191 -0.459 . . . . 0.77000000000000002 110.446 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.49 144.48 49.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.977 0.418 . . . . 1.55 111.045 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.446 HD11 ' CZ2' ' A' ' 50' ' ' TRP . 11.0 tt -145.79 143.16 21.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.939 -0.573 . . . . 1.45 111.448 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -98.88 120.14 38.83 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.383 -0.371 . . . . 1.1799999999999999 110.935 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.401 ' HB3' ' CG2' ' A' ' 90' ' ' VAL . 11.4 mt -100.28 -3.59 31.06 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.51 0.93 . . . . 1.04 113.51 -178.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.504 ' ND2' ' HA ' ' A' ' 3' ' ' LYS . 11.3 t-20 -44.69 -28.97 0.68 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.038 0.381 . . . . 0.33000000000000002 111.755 -178.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' SER . . . . . 0.407 ' O ' ' O ' ' A' ' 1' ' ' LEU . 37.1 m -84.02 -39.3 19.81 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.575 0.583 . . . . 1.5700000000000001 112.575 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.476 HG12 ' CE2' ' A' ' 50' ' ' TRP . 3.0 m -73.24 -49.22 39.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.946 0.721 . . . . 1.05 112.946 -178.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.456 ' H ' HG22 ' A' ' 90' ' ' VAL . 2.7 mt -85.07 147.58 5.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.655 0.264 . . . . 1.02 110.662 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.479 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 23.5 tt0 -137.49 163.04 32.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.817 -0.438 . . . . 1.1699999999999999 109.817 -179.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -107.12 100.23 9.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.22 0.533 . . . . 0.34000000000000002 110.184 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.407 ' CG2' ' HG3' ' A' ' 99' ' ' LYS . 18.8 t -100.37 98.56 7.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.45 -0.795 . . . . 1.04 111.825 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.3 t0 53.44 33.66 16.47 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.108 0.41 . . . . 0.23999999999999999 112.108 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.76 27.03 15.24 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.638 -0.792 . . . . 0.13 113.08 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -141.85 134.04 27.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.693 0.282 . . . . 1.6100000000000001 110.95 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.479 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 62.6 mt -74.24 122.7 23.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.445 -0.343 . . . . 1.0600000000000001 110.673 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.407 ' HG3' ' CG2' ' A' ' 94' ' ' VAL . 9.6 mttt -122.65 143.07 50.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.976 0.417 . . . . 2.0 111.488 -179.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -90.0 78.57 6.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.924 -0.58 . . . . 2.2000000000000002 110.734 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.192 -0.909 . . . . 3.8399999999999999 110.849 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.154 0 N-CA-C 112.658 -0.177 . . . . 0.0 112.658 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 6.9 mt 61.39 32.35 19.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.762 0.315 . . . . 0.0 110.944 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 145.88 134.51 2.67 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.516 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -154.12 84.38 1.14 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.622 0.249 . . . . 0.0 111.13 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 15.0 p90 -93.04 -40.75 10.35 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -179.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.415 ' CB ' ' HB3' ' A' ' 67' ' ' SER . 8.0 tp -61.86 -21.28 25.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.609 0.242 . . . . 0.0 111.379 -179.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.49 -26.73 51.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.7 0.286 . . . . 0.0 110.615 179.05 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.0 p -118.75 18.73 13.32 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.814 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.0 m -135.69 153.87 51.46 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.895 0.379 . . . . 0.0 111.165 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 ptm85 -131.46 172.72 11.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.994 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 48.87 58.14 5.65 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 43.9 p -79.46 134.31 36.53 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.1 pt20 -158.09 163.68 37.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.605 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -97.42 135.9 38.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.244 0.545 . . . . 0.0 110.944 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.8 144.84 47.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.141 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.58 -152.8 29.93 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 119.739 -1.22 . . . . 0.0 111.486 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.47 -36.86 18.8 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -140.86 35.74 1.77 Allowed 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -178.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -115.87 148.06 40.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.135 0.493 . . . . 0.0 111.951 178.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.405 ' HB2' ' CD1' ' A' ' 64' ' ' ILE . 8.6 tp -121.57 124.95 45.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.184 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.09 144.08 48.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.99 0.424 . . . . 0.0 110.206 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.55 172.47 16.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.851 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -112.02 134.86 53.31 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 176.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 82.5 m -130.71 135.07 47.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.206 0.527 . . . . 0.0 112.337 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.06 135.15 53.22 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.438 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 79.8 p -84.84 -177.7 6.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.366 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -60.37 -30.64 69.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.768 0.318 . . . . 0.0 111.361 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.06 10.34 8.31 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 66.41 36.05 5.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.11 0.481 . . . . 0.0 111.117 -178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -115.94 136.32 53.15 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -93.98 125.08 38.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.122 0.487 . . . . 0.0 112.19 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.9 m -131.46 148.5 32.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.623 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.4 m -69.85 136.59 50.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.219 0.533 . . . . 0.0 111.809 -178.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.9 t -143.24 161.64 37.75 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.03 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -142.92 156.89 44.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.483 0.658 . . . . 0.0 112.226 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -138.08 126.32 30.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.894 -1.048 . . . . 0.0 108.612 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -89.28 118.76 29.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.793 0.33 . . . . 0.0 110.761 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mp -87.99 -14.66 38.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.329 -0.396 . . . . 0.0 112.028 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.438 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.9 p-10 -57.68 -44.39 85.76 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -178.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.438 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 5.9 p30 -92.6 -10.94 35.65 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 122.089 -0.382 . . . . 0.0 111.542 178.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.45 ' CE1' ' CD2' ' A' ' 100' ' ' TYR . 19.6 m-70 -96.69 -66.34 0.91 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.404 ' CD1' ' N ' ' A' ' 41' ' ' ILE . 2.1 mp -81.09 150.47 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.001 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.406 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.1 172.14 13.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.809 -178.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.462 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 20.1 t30 -112.75 111.56 22.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.323 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 41.4 mm -110.82 90.25 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.383 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 66.93 38.97 3.44 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.932 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.01 5.38 89.34 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.778 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.4 m -115.96 135.23 54.17 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.912 0.356 . . . . 0.0 110.522 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 19.4 mt -77.39 118.84 20.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.688 0.756 . . . . 0.0 111.58 -177.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -137.97 162.95 32.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.493 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.437 ' CZ2' HG13 ' A' ' 90' ' ' VAL . 8.5 m-90 -86.79 121.05 28.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.869 0.366 . . . . 0.0 111.28 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.467 ' O ' ' N ' ' A' ' 53' ' ' SER . 32.4 tt0 -174.89 143.06 0.76 Allowed Pre-proline 0 N--CA 1.464 0.267 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.491 -179.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.406 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 31.7 Cg_endo -62.98 68.37 0.14 Allowed 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.336 2.024 . . . . 0.0 112.994 -179.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.467 ' N ' ' O ' ' A' ' 51' ' ' GLN . 4.7 p -158.96 131.73 6.97 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.422 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.71 109.96 15.74 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -177.543 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -48.0 -30.49 4.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.927 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 62.8 p -49.92 -19.04 0.61 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 53.5 mm-40 -61.43 -29.41 69.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.576 0.227 . . . . 0.0 110.895 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.462 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -127.95 0.3 5.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.537 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -113.09 148.09 35.97 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.39 0.614 . . . . 0.0 112.295 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -142.07 157.58 44.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.831 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 64.02 44.87 4.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.99 0.424 . . . . 0.0 110.342 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.2 m -69.16 138.17 53.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.5 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -145.28 153.21 41.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.529 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.405 ' CD1' ' HB2' ' A' ' 19' ' ' LEU . 27.5 mt -129.55 139.4 51.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.193 0.521 . . . . 0.0 111.537 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -133.39 107.92 8.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.172 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.15 -119.73 11.03 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.415 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.2 p -102.91 -3.08 26.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.004 0.402 . . . . 0.0 111.87 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.0 t -102.32 138.87 24.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-O 121.097 0.475 . . . . 0.0 111.962 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.1 tp -100.43 126.17 46.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.914 179.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.4 m -116.85 124.41 49.45 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.231 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.3 t -152.37 153.85 34.45 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.498 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 10.4 m -93.41 125.9 38.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.818 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 90.8 m -124.91 143.95 50.59 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -178.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . 0.412 ' HG3' ' CE1' ' A' ' 80' ' ' TYR . 16.2 tt0 -74.34 136.14 42.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.894 178.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 6.4 mtm180 -91.83 142.55 27.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.685 0.279 . . . . 0.0 110.68 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.8 m -51.9 -27.09 11.73 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.7 -179.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -83.12 2.59 34.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.786 0.327 . . . . 0.0 111.284 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.86 135.85 6.49 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.542 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.27 -170.03 13.11 Favored Glycine 0 C--N 1.318 -0.418 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 -178.502 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.412 ' CE1' ' HG3' ' A' ' 74' ' ' GLU . 18.3 m-85 -131.86 143.18 49.98 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 117.411 0.605 . . . . 0.0 111.56 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -153.94 130.07 10.36 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.471 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.498 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.6 t -91.86 135.3 34.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.686 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 85.9 p -124.23 158.05 33.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.256 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.75 144.41 49.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.844 0.354 . . . . 0.0 111.092 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.429 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 11.5 tt -144.71 142.56 23.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.291 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -97.63 117.79 32.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.646 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 5.8 mt -98.54 -5.16 32.66 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -45.37 -27.99 0.78 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 122.151 -0.343 . . . . 0.0 111.754 -178.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.71 -40.38 25.43 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.443 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.3 m -73.47 -53.15 18.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.443 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.1 mp -80.85 147.95 5.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.972 0.415 . . . . 0.0 111.202 -179.44 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' A' ' 99' ' ' LYS . 15.2 tt0 -138.07 164.63 28.62 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.838 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -106.42 99.66 9.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.309 0.576 . . . . 0.0 110.365 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 39.2 t -98.98 97.14 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.92 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.2 t0 53.98 31.8 14.19 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.68 0.276 . . . . 0.0 111.565 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.11 28.22 11.15 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.794 -0.717 . . . . 0.0 113.414 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 42.5 m -139.76 136.35 34.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.882 0.372 . . . . 0.0 111.138 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 77.0 mt -74.04 119.36 18.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.648 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.418 ' O ' ' N ' ' A' ' 92' ' ' GLU . 4.1 mmmt -125.99 137.14 53.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.984 0.421 . . . . 0.0 111.966 -179.136 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.45 ' CD2' ' CE1' ' A' ' 40' ' ' HIS . 19.5 t80 -78.41 148.81 33.49 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.314 179.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.432 ' N ' ' CD1' ' A' ' 100' ' ' TYR . 23.5 tt0 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.309 -0.853 . . . . 0.0 111.031 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 112.494 -0.243 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.3 tt -153.78 -47.3 0.09 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.738 0.304 . . . . 0.0 111.018 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 149.07 123.46 1.27 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.804 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -151.89 84.39 1.28 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.851 0.358 . . . . 0.0 110.711 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.439 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 16.1 p90 -88.45 -42.32 12.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.545 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.425 ' CB ' ' HB3' ' A' ' 67' ' ' SER . 6.4 tp -62.24 -21.27 26.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.615 0.245 . . . . 0.0 111.389 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -76.66 -27.33 55.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.742 0.306 . . . . 0.0 111.033 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 50.1 p -118.9 18.37 13.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.664 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 77.8 m -131.42 155.08 47.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.057 0.456 . . . . 0.0 111.545 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -132.51 172.95 11.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.889 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.0 p30 48.82 58.1 5.68 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.2 p -79.49 130.77 35.71 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -157.05 163.26 39.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.417 -179.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.492 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.86 136.42 38.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.822 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.06 145.52 46.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.345 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.27 -152.28 33.78 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.788 -1.196 . . . . 0.0 111.325 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.19 -37.17 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.452 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.63 35.36 1.63 Allowed 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.438 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.8 OUTLIER -113.71 147.9 37.36 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.937 0.399 . . . . 0.0 111.662 179.016 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 11.4 tp -120.11 123.61 43.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.397 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.63 143.69 48.54 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.49 172.51 16.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.214 -178.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -110.07 134.12 52.49 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 75.0 m -130.67 132.91 45.68 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.385 -0.526 . . . . 0.0 112.082 -178.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.5 ptpt -66.93 136.33 55.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.357 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 71.2 p -85.21 -176.91 6.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.49 179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -62.29 -29.71 70.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.229 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.96 10.35 8.1 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 66.9 38.36 3.68 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.12 0.486 . . . . 0.0 111.511 -178.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.451 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 3.0 mm-40 -118.28 135.92 54.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.979 178.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -93.07 124.85 37.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.8 0.333 . . . . 0.0 111.444 -178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.5 m -130.99 151.78 36.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.896 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.8 p -71.5 134.29 46.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.173 0.511 . . . . 0.0 111.916 -178.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 t -144.17 161.37 39.04 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.368 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -143.7 156.64 44.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.298 0.571 . . . . 0.0 111.893 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -136.57 127.59 42.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.302 -0.863 . . . . 0.0 108.977 179.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -87.49 116.98 25.98 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.699 0.285 . . . . 0.0 111.531 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.424 ' O ' ' N ' ' A' ' 41' ' ' ILE . 3.9 mp -87.59 -14.84 39.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.91 179.106 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.433 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -56.59 -48.24 77.82 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.297 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.418 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -90.96 -10.08 43.68 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 122.13 -0.356 . . . . 0.0 111.384 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 -95.21 -62.98 1.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.424 ' N ' ' O ' ' A' ' 37' ' ' LEU . 22.7 mm -80.73 151.04 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.839 178.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.415 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -140.91 172.23 12.97 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.107 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.485 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 34.3 t30 -112.18 108.85 18.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.682 -179.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 50.8 mm -109.64 89.78 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.315 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 43.9 t0 66.21 38.05 4.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.332 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.25 0.63 88.55 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.182 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.4 m -112.08 137.36 50.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.924 0.393 . . . . 0.0 111.003 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 26.8 mt -76.95 117.5 18.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.705 0.764 . . . . 0.0 111.565 -177.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -138.44 162.86 33.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.836 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.476 ' CZ2' ' CG1' ' A' ' 90' ' ' VAL . 4.0 m-90 -84.86 123.13 30.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.039 0.447 . . . . 0.0 111.865 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -172.17 147.17 1.8 Allowed Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.255 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.418 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 51.6 Cg_endo -69.65 63.7 1.73 Allowed 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.231 1.954 . . . . 0.0 112.305 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.415 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.1 p -158.28 135.15 9.79 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.32 179.111 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.01 109.71 15.86 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.517 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.452 ' CZ ' ' CB ' ' A' ' 17' ' ' SER . 37.6 p90 -48.92 -29.4 4.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.466 178.28 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.3 p -48.31 -17.89 0.18 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.883 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -63.75 -29.01 70.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.623 0.249 . . . . 0.0 111.39 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.485 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -127.51 -0.94 6.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.473 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.7 m -110.53 147.97 33.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.202 0.525 . . . . 0.0 111.931 -178.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.7 p90 -142.29 157.61 44.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.045 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.6 m120 64.14 47.29 3.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.947 0.403 . . . . 0.0 110.856 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.1 m -70.79 135.03 47.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.689 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.12 150.36 42.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.575 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.492 HG13 ' HB2' ' A' ' 13' ' ' LEU . 33.6 mt -128.68 138.76 53.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.376 0.608 . . . . 0.0 111.891 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -136.09 108.19 7.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.16 -0.927 . . . . 0.0 108.963 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.53 -121.36 11.01 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.442 -0.885 . . . . 0.0 111.449 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.425 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.2 p -101.68 -4.17 26.98 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 t -101.41 140.37 20.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.033 0.444 . . . . 0.0 111.99 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.7 tp -102.49 125.97 49.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.349 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.1 m -116.11 124.69 51.0 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.5 t -151.79 153.77 34.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.704 0.287 . . . . 0.0 111.485 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 18.8 m -94.83 126.22 40.01 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 178.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 88.1 m -125.95 144.98 50.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.351 0.596 . . . . 0.0 112.37 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -74.26 137.43 42.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.914 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -91.93 142.5 27.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.665 0.269 . . . . 0.0 110.446 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 56.4 m -52.14 -26.8 12.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.539 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -83.43 2.03 38.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.579 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.45 134.99 6.87 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.774 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.09 -169.14 12.76 Favored Glycine 0 C--N 1.319 -0.41 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -131.04 143.31 50.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 117.337 0.568 . . . . 0.0 111.308 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -153.9 128.85 9.53 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.167 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.7 t -91.97 134.71 34.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.495 -179.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 21.8 p -121.96 158.03 29.97 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.276 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.6 p -123.2 145.02 48.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.878 0.371 . . . . 0.0 110.978 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.471 HD11 HG21 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -146.99 145.03 19.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.628 -179.822 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -98.56 117.91 34.07 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.244 179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.434 ' O ' HG21 ' A' ' 90' ' ' VAL . 6.3 mt -100.1 -6.47 26.26 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.439 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 7.0 t-20 -45.01 -27.04 0.5 Allowed 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -178.392 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.7 m -80.26 -38.34 31.11 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.476 ' CG1' ' CZ2' ' A' ' 50' ' ' TRP . 3.2 m -75.49 -51.83 19.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -178.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.442 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -81.57 147.49 6.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.034 0.445 . . . . 0.0 111.247 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.43 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 23.1 tt0 -139.08 167.0 23.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.266 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -106.26 99.56 9.14 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.18 0.514 . . . . 0.0 110.378 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.416 ' CG2' ' HG3' ' A' ' 99' ' ' LYS . 58.6 t -97.95 96.51 5.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.999 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.5 t0 53.45 32.84 14.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.632 0.253 . . . . 0.0 111.515 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.44 28.38 11.59 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.831 -0.7 . . . . 0.0 113.345 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.7 m -141.1 135.06 30.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 0.0 111.009 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.43 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 54.1 mt -73.39 119.94 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.759 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.3 mttm -123.81 133.95 53.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.467 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.403 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 36.6 t80 -79.0 -32.06 45.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.34 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.871 179.785 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.16 0 N-CA-C 112.436 -0.265 . . . . 0.0 112.436 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 16.5 tp -144.17 108.72 4.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.82 0.343 . . . . 0.0 110.81 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 82.28 -106.31 2.68 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.808 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.6 mmtm 62.48 66.46 0.78 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.841 0.353 . . . . 0.0 110.988 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.438 ' CE2' ' HA ' ' A' ' 88' ' ' ASN . 22.8 p90 -91.39 -40.39 11.47 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.617 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.428 ' O ' HG13 ' A' ' 5' ' ' ILE . 3.8 tp -64.43 -18.16 22.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.674 0.274 . . . . 0.0 111.272 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.31 -24.19 60.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.873 0.368 . . . . 0.0 110.577 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.4 p -118.46 -3.77 10.9 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.682 179.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.8 m -108.19 152.58 24.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.966 0.412 . . . . 0.0 111.482 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -132.09 172.42 12.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.751 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.403 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 6.2 p-10 48.43 58.05 5.6 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 66.9 p -79.67 132.75 36.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.319 178.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -158.71 163.95 36.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.192 -179.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.462 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.42 136.38 37.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.147 0.499 . . . . 0.0 110.863 -179.666 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.22 143.81 47.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.098 179.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.29 -152.78 32.9 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 119.89 -1.147 . . . . 0.0 111.462 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -85.83 -37.09 19.59 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.454 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -141.43 36.23 1.67 Allowed 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 8.2 mp0 -115.83 146.67 41.78 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.808 0.337 . . . . 0.0 111.81 178.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.404 ' N ' ' CD1' ' A' ' 37' ' ' LEU . 10.7 tp -119.86 124.76 46.86 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.21 142.66 47.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.2 172.72 16.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.189 -178.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -115.45 133.54 55.93 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 177.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.7 m -130.77 135.66 47.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.077 0.465 . . . . 0.0 111.62 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.7 ptpt -66.88 136.93 56.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.675 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 42.4 p -84.91 -176.92 6.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.696 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.8 mmt-85 -61.48 -30.48 70.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.801 0.334 . . . . 0.0 110.995 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.12 9.17 9.05 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 66.99 38.81 3.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.317 0.579 . . . . 0.0 111.099 -178.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.422 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 60.8 mt-30 -119.42 134.89 54.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.283 -0.872 . . . . 0.0 108.872 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 43.4 m-85 -93.09 124.65 37.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.972 0.415 . . . . 0.0 111.544 -178.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.1 m -130.36 153.58 39.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.811 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.24 134.46 44.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.27 0.557 . . . . 0.0 112.186 -178.478 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.8 t -143.59 161.21 39.08 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.28 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.0 ttmt -142.86 156.73 44.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.341 0.591 . . . . 0.0 111.887 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.417 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.1 tp -135.03 128.05 49.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.017 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -88.33 115.42 25.82 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.626 0.25 . . . . 0.0 111.296 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.1 mp -86.59 -15.44 39.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.344 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.422 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -57.09 -45.22 83.53 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 -178.757 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.402 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 1.3 p30 -91.89 -10.41 39.73 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.477 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 26.8 m-70 -98.33 -63.33 1.14 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.454 ' CD1' ' CD1' ' A' ' 50' ' ' TRP . 20.6 mm -80.6 147.73 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.952 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -141.07 172.24 12.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.526 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.458 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 25.9 t30 -113.11 111.72 22.61 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.164 -179.189 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.407 ' CD1' ' HB2' ' A' ' 49' ' ' LYS . 3.0 mp -112.01 89.34 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.909 0.385 . . . . 0.0 111.032 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.7 t0 67.78 38.26 2.97 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.258 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.75 0.88 87.57 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.564 -0.827 . . . . 0.0 113.424 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.4 m -110.72 135.41 51.36 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.307 0.554 . . . . 0.0 110.893 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.7 mt -77.63 118.76 20.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.454 0.645 . . . . 0.0 111.249 -178.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.407 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 28.2 mttt -138.99 163.24 32.89 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.514 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.454 ' CD1' ' CD1' ' A' ' 41' ' ' ILE . 7.7 m-90 -85.89 118.68 25.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.133 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.407 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 43.0 tt0 -174.66 143.14 0.8 Allowed Pre-proline 0 N--CA 1.465 0.31 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.005 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.407 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 28.4 Cg_endo -64.55 74.67 0.2 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.093 1.862 . . . . 0.0 113.164 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -165.75 135.19 3.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.348 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.464 ' N ' ' OD1' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.69 109.31 15.98 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -177.688 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.422 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 38.6 p90 -50.0 -28.41 6.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.808 178.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.1 p -49.32 -16.99 0.21 Allowed 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -63.92 -29.62 70.78 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 122.16 -0.338 . . . . 0.0 111.351 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.458 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -128.2 1.04 5.8 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.073 -0.251 . . . . 0.0 111.479 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.4 m -111.81 147.66 35.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.231 0.538 . . . . 0.0 112.095 -178.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -143.63 157.72 44.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.886 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 64.15 46.33 3.69 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.029 0.442 . . . . 0.0 110.89 -179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 35.8 m -70.53 137.6 50.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.097 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.66 151.67 41.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.986 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.462 HG13 ' HB2' ' A' ' 13' ' ' LEU . 54.4 mt -130.66 138.77 52.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 121.325 0.583 . . . . 0.0 111.889 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -136.03 111.26 9.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.273 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.82 -121.1 13.65 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.122 -1.037 . . . . 0.0 110.734 -178.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.5 p -103.07 -3.21 26.25 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.6 t -100.97 138.19 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 121.028 0.442 . . . . 0.0 111.937 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.8 tp -102.49 124.37 47.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.142 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.5 m -115.67 126.92 54.75 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 t -152.01 153.86 34.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.768 0.318 . . . . 0.0 111.455 -179.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.2 m -93.9 126.13 38.92 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.0 m -126.88 144.93 50.84 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.467 0.651 . . . . 0.0 112.508 -178.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -74.64 137.32 42.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.605 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -90.73 144.72 25.44 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.7 m -51.46 -26.46 8.23 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -83.17 3.07 32.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.634 0.254 . . . . 0.0 111.489 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.32 138.47 7.34 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.089 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.77 -169.83 13.09 Favored Glycine 0 C--N 1.318 -0.448 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -129.5 140.42 51.27 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 117.196 0.498 . . . . 0.0 111.066 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -154.01 128.93 9.49 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.406 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.6 t -93.41 134.87 35.2 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.916 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 37.6 p -121.98 158.3 29.41 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.516 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -122.12 144.52 48.89 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.662 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.6 tt -145.67 142.58 21.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.605 179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -97.38 121.11 38.91 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.078 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.2 mt -100.58 -4.16 29.1 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -178.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.438 ' HA ' ' CE2' ' A' ' 4' ' ' PHE . 13.1 t-20 -44.75 -28.44 0.63 Allowed 'General case' 0 N--CA 1.468 0.436 0 O-C-N 122.097 -0.377 . . . . 0.0 111.756 -178.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 49.1 m -81.64 -41.78 20.95 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.47 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.3 m -72.13 -52.75 22.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -177.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.47 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -81.99 145.49 8.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.108 0.48 . . . . 0.0 111.47 -178.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 9.1 tt0 -135.96 166.25 23.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.062 -178.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -107.95 99.53 8.98 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.27 0.557 . . . . 0.0 110.169 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.2 t -97.63 96.68 5.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.693 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 22.1 t0 53.42 33.18 15.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.613 0.244 . . . . 0.0 111.599 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.12 28.52 11.67 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.508 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.2 t -140.55 135.33 31.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.901 0.351 . . . . 0.0 110.875 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.417 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 55.6 mt -74.27 120.47 19.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.869 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -127.01 138.09 53.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.892 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.477 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 15.0 t80 -86.68 133.06 33.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.845 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.146 -0.931 . . . . 0.0 111.269 -179.46 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 N-CA-C 112.514 -0.234 . . . . 0.0 112.514 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 8.1 tp -100.1 159.62 14.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.748 0.309 . . . . 0.0 110.759 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -63.18 140.62 45.41 Favored Glycine 0 CA--C 1.518 0.231 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.864 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.72 83.77 1.29 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.734 0.302 . . . . 0.0 110.88 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.439 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 17.0 p90 -90.97 -41.85 10.88 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.704 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.433 ' CB ' ' HB3' ' A' ' 67' ' ' SER . 6.8 tp -61.83 -22.56 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-O 120.679 0.276 . . . . 0.0 111.498 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -75.24 -24.53 57.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.069 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.8 p -118.05 -3.69 11.09 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 58.2 m -111.14 155.17 23.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.882 0.373 . . . . 0.0 111.069 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -130.22 172.43 11.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.79 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 48.08 59.52 4.19 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 16.6 p -78.78 132.21 36.82 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 178.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -157.43 163.62 38.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.938 0.399 . . . . 0.0 111.79 -179.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.421 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.47 136.49 37.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.706 179.601 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.86 146.48 46.53 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.223 179.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.64 -153.15 25.12 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 119.771 -1.204 . . . . 0.0 111.365 -178.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.7 m -85.52 -36.95 20.18 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -140.81 36.11 1.79 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.0 mp0 -115.23 149.64 37.41 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.153 0.501 . . . . 0.0 112.172 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.403 ' HB2' HD11 ' A' ' 37' ' ' LEU . 19.4 tp -122.45 123.06 40.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.239 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.02 143.98 46.79 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.47 172.82 15.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.302 -178.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -110.98 133.99 52.95 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 61.4 m -130.8 132.08 45.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.052 0.453 . . . . 0.0 111.92 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.11 137.0 56.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.411 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 53.3 p -87.3 -177.74 6.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.516 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.9 mmt85 -62.2 -28.94 70.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.557 0.218 . . . . 0.0 111.288 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.36 8.39 9.34 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 66.66 38.0 4.15 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.263 0.554 . . . . 0.0 110.653 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -118.88 136.08 54.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.977 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -92.69 124.74 36.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.931 0.396 . . . . 0.0 111.452 -178.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.2 m -129.81 148.67 33.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.417 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.5 t -71.61 137.15 47.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.179 0.514 . . . . 0.0 111.946 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 t -145.97 162.35 38.01 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.643 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -143.88 155.84 44.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.316 0.579 . . . . 0.0 112.043 -179.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.413 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.1 tp -135.26 127.77 47.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -89.1 118.6 28.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.72 0.295 . . . . 0.0 110.863 -177.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.403 HD11 ' HB2' ' A' ' 19' ' ' LEU . 3.7 mp -88.96 -16.11 32.57 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.852 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.401 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.1 p-10 -56.57 -43.93 80.47 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -178.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.415 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.3 OUTLIER -92.71 -10.59 36.58 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 122.201 -0.312 . . . . 0.0 111.601 178.92 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 -96.65 -64.92 1.0 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.419 HD13 ' CD1' ' A' ' 50' ' ' TRP . 23.2 mm -80.93 148.49 5.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.734 178.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.41 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -138.52 172.26 13.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.84 -179.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.412 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 30.0 t30 -111.96 109.59 19.45 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.464 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.4 HG22 HD13 ' A' ' 44' ' ' ILE . 37.8 mm -109.54 88.98 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.678 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 49.8 t0 67.17 39.68 3.03 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.255 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.48 0.75 88.11 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.829 -0.7 . . . . 0.0 113.439 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 39.1 m -113.78 138.23 50.54 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.033 0.444 . . . . 0.0 111.429 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.6 mt -77.17 117.17 18.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.645 0.736 . . . . 0.0 111.118 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 46.4 mttt -135.84 162.49 32.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.859 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.462 ' CZ2' HG11 ' A' ' 90' ' ' VAL . 4.9 m-90 -85.33 118.04 24.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.966 0.412 . . . . 0.0 111.149 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.408 ' O ' ' N ' ' A' ' 53' ' ' SER . 29.2 tt0 -173.04 142.25 1.02 Allowed Pre-proline 0 N--CA 1.465 0.324 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.705 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.415 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 34.3 Cg_endo -64.97 73.29 0.23 Allowed 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 121.968 1.779 . . . . 0.0 112.455 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.1 p -162.85 134.57 5.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.69 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.23 109.34 16.42 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 29.8 p90 -48.5 -30.74 5.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.876 178.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.2 p -49.14 -17.82 0.26 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -178.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -62.02 -28.66 69.74 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.136 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.412 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.5 p -128.56 -0.09 5.55 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.387 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.2 m -110.69 148.8 31.52 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -141.1 156.97 45.9 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.248 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 62.96 46.53 4.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.98 0.419 . . . . 0.0 110.632 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.0 m -69.31 135.96 51.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.188 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.16 152.57 41.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.673 -179.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.421 HG13 ' HB2' ' A' ' 13' ' ' LEU . 52.4 mt -129.83 140.1 49.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.284 0.564 . . . . 0.0 111.905 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -135.23 108.83 7.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.257 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.18 -120.95 14.55 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.445 -0.883 . . . . 0.0 111.012 -178.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.433 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.5 p -100.85 -3.17 30.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.144 0.472 . . . . 0.0 111.858 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.3 t -101.95 138.51 25.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-O 121.01 0.433 . . . . 0.0 111.922 -179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.6 tp -101.13 124.92 47.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.394 179.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 2.9 m -115.16 125.12 53.05 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.2 t -151.94 154.09 35.38 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.616 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.9 m -93.88 125.81 38.72 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 84.8 m -127.95 145.3 51.01 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 -178.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -75.63 136.47 40.46 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.585 178.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -92.21 146.01 24.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.669 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.3 m -51.79 -27.38 12.12 Favored 'General case' 0 N--CA 1.462 0.155 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -82.95 2.3 35.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.524 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.95 137.79 6.83 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.417 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.19 -169.46 12.89 Favored Glycine 0 C--N 1.319 -0.396 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -178.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -132.03 142.18 49.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.282 0.541 . . . . 0.0 111.15 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -154.32 128.28 8.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.124 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.462 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.0 OUTLIER -91.61 134.16 34.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.264 -179.479 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 p -119.29 158.27 26.39 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.588 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 4.4 p -120.15 142.75 48.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.818 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.457 HD13 ' CZ2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -148.07 144.95 18.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.529 179.736 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -100.79 120.73 40.54 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.585 -179.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 12.1 mt -102.02 -3.25 27.98 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -179.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.423 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 6.3 t-20 -45.0 -26.96 0.49 Allowed 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.2 m -80.22 -42.17 23.79 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.462 HG11 ' CZ2' ' A' ' 50' ' ' TRP . 3.7 m -71.63 -52.9 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -178.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.447 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.2 mp -80.53 147.68 6.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.945 0.402 . . . . 0.0 111.342 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.402 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 12.9 tt0 -139.46 167.2 22.63 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.473 -178.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -105.8 99.5 9.1 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.997 0.427 . . . . 0.0 110.639 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.2 t -100.34 94.87 3.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.787 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 20.5 t0 55.36 32.58 19.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.674 0.273 . . . . 0.0 111.448 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.28 27.87 14.57 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.915 -0.659 . . . . 0.0 113.204 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.3 t -139.05 134.02 32.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.73 0.3 . . . . 0.0 111.059 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.413 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 78.2 mt -72.74 118.78 16.09 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.945 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -124.74 140.5 52.88 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -84.8 143.46 29.09 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.014 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.32 -0.848 . . . . 0.0 110.811 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.221 0 N-CA-C 112.472 -0.251 . . . . 0.0 112.472 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 31.9 mt -62.53 -52.0 65.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.77 0.319 . . . . 0.0 110.86 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.54 -82.64 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.662 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.5 mmtt 65.92 70.71 0.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.968 0.413 . . . . 0.0 110.681 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.428 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 18.3 p90 -91.85 -38.75 12.14 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.349 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.413 ' CB ' ' HB3' ' A' ' 67' ' ' SER . 6.7 tp -66.24 -13.18 15.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -77.54 -26.82 51.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.891 0.377 . . . . 0.0 110.878 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.2 p -118.56 0.34 11.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.528 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 76.0 m -112.31 153.44 27.21 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 121.015 0.436 . . . . 0.0 111.047 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.8 ptt180 -132.57 172.6 12.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.989 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 48.91 58.0 5.82 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.4 p -79.32 131.64 36.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.979 178.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -155.97 163.01 40.27 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.4 -179.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.511 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.5 OUTLIER -97.42 135.79 38.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.546 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.42 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.86 144.34 47.43 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.272 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.38 -151.71 31.34 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 119.799 -1.191 . . . . 0.0 111.3 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.65 -37.06 18.38 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.419 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -140.54 35.44 1.83 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.4 mp0 -115.15 146.89 40.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.059 0.457 . . . . 0.0 111.781 179.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.411 ' HB2' HD13 ' A' ' 37' ' ' LEU . 14.6 tp -122.04 124.25 43.52 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.014 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.81 144.07 46.54 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.935 0.398 . . . . 0.0 110.141 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.31 172.35 16.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.17 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -114.57 134.05 55.34 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 177.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 55.7 m -130.57 134.15 46.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.281 0.563 . . . . 0.0 111.894 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.2 ptpt -66.04 137.48 57.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.423 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 66.0 p -85.9 -176.43 5.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.644 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -62.93 -30.56 71.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.231 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.81 9.68 7.61 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 66.88 37.67 3.94 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.132 0.492 . . . . 0.0 111.425 -178.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.428 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 54.4 mt-30 -117.25 137.69 52.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.009 177.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -94.85 125.06 39.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.859 0.361 . . . . 0.0 111.849 -178.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 m -131.04 151.05 35.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.0 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.7 p -71.92 135.8 46.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.246 0.546 . . . . 0.0 111.876 -178.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.4 t -143.26 161.42 38.33 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.214 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 13.4 ttmt -142.2 156.1 45.31 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.411 0.624 . . . . 0.0 111.933 -179.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.419 HG12 HG12 ' A' ' 91' ' ' ILE . 1.3 tp -138.42 125.0 26.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.115 -0.948 . . . . 0.0 108.818 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -86.8 119.13 26.7 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.677 0.275 . . . . 0.0 111.153 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.418 ' O ' ' N ' ' A' ' 41' ' ' ILE . 4.4 mp -87.99 -16.0 34.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.634 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.444 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -57.69 -44.81 86.11 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.444 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.4 OUTLIER -91.76 -10.4 40.11 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 122.106 -0.371 . . . . 0.0 111.061 179.285 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 23.6 m-70 -97.87 -68.43 0.8 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.436 ' N ' ' CD1' ' A' ' 41' ' ' ILE . 1.7 mp -78.59 150.67 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.287 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.421 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.09 172.58 12.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.953 -179.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.491 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 26.8 t30 -111.34 109.45 19.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.083 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 33.3 mm -109.88 89.69 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.407 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 55.6 t0 68.0 38.78 2.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.259 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.16 0.7 89.61 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.824 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.9 m -112.81 136.94 51.85 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.863 0.363 . . . . 0.0 110.882 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.5 mt -77.41 117.39 18.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.638 0.733 . . . . 0.0 111.281 -178.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.1 mttm -137.51 162.7 33.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.721 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.472 ' CE2' HG13 ' A' ' 90' ' ' VAL . 9.2 m-90 -87.27 121.89 30.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.087 0.47 . . . . 0.0 111.561 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 53' ' ' SER . 3.2 tp60 -175.06 143.39 0.76 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.873 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.42 ' HD2' ' HG3' ' A' ' 51' ' ' GLN . 23.4 Cg_endo -62.41 69.43 0.12 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.208 1.939 . . . . 0.0 112.553 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -160.49 134.75 7.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.834 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.431 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -82.49 108.42 15.88 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.158 0.504 . . . . 0.0 112.027 -178.068 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.419 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 33.4 p90 -47.63 -31.33 4.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.301 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 45.8 p -47.78 -16.25 0.07 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.316 -0.857 . . . . 0.0 113.006 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -64.56 -26.83 68.59 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.559 0.219 . . . . 0.0 111.381 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.491 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -134.01 5.41 3.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.322 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.6 m -115.18 148.98 38.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.228 0.537 . . . . 0.0 111.837 -178.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -142.84 157.63 44.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.968 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.4 m-20 63.34 46.07 4.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.981 0.42 . . . . 0.0 110.954 -179.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 43.2 m -69.59 136.02 50.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.496 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.33 151.03 43.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.511 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.511 HG13 ' HB2' ' A' ' 13' ' ' LEU . 52.2 mt -129.81 140.89 47.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.225 0.536 . . . . 0.0 111.728 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -138.13 110.4 7.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.01 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.36 -122.28 14.77 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.269 -0.967 . . . . 0.0 111.101 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.413 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.3 p -101.32 -2.37 31.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.5 t -102.63 138.62 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.012 0.434 . . . . 0.0 112.109 -179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.432 HD11 ' N ' ' A' ' 70' ' ' THR . 8.7 tp -102.53 126.93 49.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.329 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.432 ' N ' HD11 ' A' ' 69' ' ' LEU . 3.1 m -117.56 125.95 51.72 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.4 t -151.83 153.43 34.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.607 0.241 . . . . 0.0 111.16 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 18.5 m -94.2 126.02 39.18 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 85.4 m -126.45 145.15 50.6 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -74.51 136.52 42.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.772 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.1 mtm180 -91.72 143.61 26.37 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 69.2 m -51.83 -27.23 11.82 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -83.67 2.28 38.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.65 0.262 . . . . 0.0 111.531 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.81 136.95 7.4 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.911 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.96 -169.73 13.07 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 111.101 -0.8 . . . . 0.0 111.101 -178.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -130.8 142.04 50.38 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 117.304 0.552 . . . . 0.0 111.22 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -154.15 129.13 9.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.517 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -92.75 134.33 35.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.271 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.3 p -122.77 158.18 30.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.377 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 57.8 p -121.01 144.88 48.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.906 0.384 . . . . 0.0 111.059 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 13.5 tt -144.21 143.0 23.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.399 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -96.88 115.86 28.17 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.995 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.417 ' O ' HG22 ' A' ' 90' ' ' VAL . 16.1 mt -95.91 -7.19 37.38 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.428 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 13.9 t-20 -44.7 -27.83 0.54 Allowed 'General case' 0 N--CA 1.467 0.392 0 O-C-N 122.178 -0.326 . . . . 0.0 111.869 -178.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.88 -37.88 26.22 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.472 HG13 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -74.36 -53.87 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 -178.181 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.46 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -80.95 147.78 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.05 0.452 . . . . 0.0 111.465 -178.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.411 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 14.4 tt0 -138.07 164.45 29.08 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.852 -178.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 20.8 t30 -106.67 99.72 9.28 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.087 0.47 . . . . 0.0 110.528 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.439 ' HB ' ' CE ' ' A' ' 99' ' ' LYS . 39.1 t -99.86 96.65 5.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.187 179.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 19.2 t0 53.62 33.0 15.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.66 28.79 13.23 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.697 -0.763 . . . . 0.0 113.054 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -141.91 134.33 28.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.746 0.308 . . . . 0.0 110.925 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.411 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 49.8 mt -75.06 119.14 18.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.12 0.486 . . . . 0.0 111.51 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.439 ' CE ' ' HB ' ' A' ' 94' ' ' VAL . 0.9 OUTLIER -122.85 153.41 39.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.084 179.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -88.27 -61.25 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.928 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.834 -179.926 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.148 0 N-CA-C 112.487 -0.245 . . . . 0.0 112.487 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.21 -59.75 2.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.82 0.343 . . . . 0.0 110.914 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 164.35 149.4 5.77 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.464 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -154.9 85.37 1.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.732 0.301 . . . . 0.0 111.018 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.437 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 19.6 p90 -92.78 -40.8 10.47 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.543 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.405 ' CB ' ' HB3' ' A' ' 67' ' ' SER . 7.8 tp -63.02 -19.84 24.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.673 0.273 . . . . 0.0 111.393 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -78.48 -26.37 46.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.766 0.317 . . . . 0.0 110.726 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.6 p -118.32 13.83 13.71 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.984 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.9 m -129.77 156.2 44.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.933 0.397 . . . . 0.0 111.167 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.34 172.5 12.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.034 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 47.98 58.56 4.95 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.0 p -79.06 132.79 36.73 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.44 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -157.36 163.81 38.22 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.973 0.416 . . . . 0.0 111.453 -179.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.454 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.5 OUTLIER -97.49 136.1 38.4 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.035 -179.835 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -118.6 143.45 46.79 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.04 -150.75 31.93 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 119.877 -1.154 . . . . 0.0 111.712 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -87.21 -36.62 17.87 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -178.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.404 ' OG ' ' HB3' ' A' ' 38' ' ' ASP . 3.1 p -140.69 35.07 1.8 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 3.0 mp0 -115.45 148.02 39.9 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.205 0.526 . . . . 0.0 112.123 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 11.8 tp -122.06 123.83 42.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.319 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.29 143.61 47.25 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.19 172.33 16.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.081 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -111.27 133.56 53.51 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 86.1 m -131.01 134.2 46.47 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.416 -0.514 . . . . 0.0 112.277 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.3 ptpt -67.11 137.42 56.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.728 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 36.2 p -86.05 -178.96 6.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.602 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -61.41 -29.13 69.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.709 0.29 . . . . 0.0 111.222 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.16 10.41 8.35 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 66.51 36.33 5.07 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.138 0.494 . . . . 0.0 111.345 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -116.42 137.61 52.02 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -93.92 125.3 38.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.945 0.402 . . . . 0.0 111.864 -178.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.4 m -131.0 150.74 34.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.696 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -72.53 135.96 45.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.145 0.498 . . . . 0.0 111.968 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.6 t -143.7 161.38 38.73 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.208 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -141.93 157.24 45.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.509 0.671 . . . . 0.0 112.283 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.3 tp -138.47 125.79 27.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.076 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -87.88 119.13 27.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.664 0.268 . . . . 0.0 110.998 -178.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.412 ' O ' ' N ' ' A' ' 41' ' ' ILE . 4.1 mp -88.31 -14.54 38.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.5 p-10 -58.49 -43.46 89.02 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.19 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.455 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.9 OUTLIER -92.16 -10.94 36.97 Favored 'General case' 0 N--CA 1.465 0.306 0 O-C-N 122.096 -0.377 . . . . 0.0 111.8 179.568 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.451 ' CE1' ' CD2' ' A' ' 100' ' ' TYR . 38.9 m-70 -97.8 -59.77 1.7 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.412 ' N ' ' O ' ' A' ' 37' ' ' LEU . 32.5 mm -81.28 146.16 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.575 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.456 ' HB2' ' HB2' ' A' ' 51' ' ' GLN . . . -139.02 170.34 16.16 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.298 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.449 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 29.8 t30 -112.95 109.68 19.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.53 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.2 mm -110.02 89.6 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.069 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.4 t0 68.52 39.43 2.13 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.089 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.28 5.57 89.5 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.864 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 m -115.23 136.42 53.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.793 0.33 . . . . 0.0 110.821 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 27.8 mt -77.53 116.15 17.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.666 0.746 . . . . 0.0 111.333 -178.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 mmtt -136.34 162.63 32.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.192 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.411 ' CE2' HG12 ' A' ' 90' ' ' VAL . 7.7 m-90 -86.07 123.47 31.41 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.323 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.456 ' HB2' ' HB2' ' A' ' 42' ' ' ALA . 2.8 mt-30 -172.03 152.6 2.95 Favored Pre-proline 0 N--CA 1.465 0.323 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.773 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.06 63.26 4.14 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.023 1.815 . . . . 0.0 112.359 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.425 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 4.4 p -155.92 135.03 12.11 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.506 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -81.22 109.56 15.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.182 0.515 . . . . 0.0 112.259 -177.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -47.3 -30.59 3.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.708 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 81.9 p -48.58 -18.12 0.22 Allowed 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -61.21 -28.07 68.89 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.933 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.449 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 6.1 p -130.7 1.34 4.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.3 m -111.47 149.18 31.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.192 0.52 . . . . 0.0 112.336 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.6 p90 -141.55 156.56 45.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.817 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 63.98 47.22 3.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.884 0.373 . . . . 0.0 111.242 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.4 m -69.92 134.89 48.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.453 179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.72 152.14 43.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.599 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.454 HG13 ' HB2' ' A' ' 13' ' ' LEU . 39.5 mt -128.92 138.06 55.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.4 0.619 . . . . 0.0 112.034 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -133.77 106.46 7.35 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.079 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.31 -121.89 11.96 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.49 -0.862 . . . . 0.0 111.58 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.405 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 24.3 p -99.41 -4.4 31.61 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.5 t -102.04 140.51 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 121.109 0.48 . . . . 0.0 112.191 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.3 tp -102.55 126.12 49.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.085 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.0 m -116.0 125.29 52.3 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.218 -0.289 . . . . 0.0 110.218 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.6 t -152.02 153.59 34.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.612 0.244 . . . . 0.0 111.353 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 22.1 m -95.05 126.44 40.39 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 76.6 m -126.02 145.06 50.47 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -74.5 136.58 42.21 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.848 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -93.2 144.37 25.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.691 0.282 . . . . 0.0 111.119 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.3 m -52.02 -28.83 18.49 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.635 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -82.61 1.7 36.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.638 0.256 . . . . 0.0 111.479 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.07 136.15 7.19 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.707 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.5 -170.91 13.47 Favored Glycine 0 C--N 1.319 -0.392 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 -178.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -129.54 143.12 50.69 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 117.286 0.543 . . . . 0.0 111.059 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -153.81 130.13 10.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.174 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.533 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.9 t -92.7 134.89 34.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.636 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 26.4 p -122.21 157.79 30.83 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.197 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.1 p -123.69 145.09 49.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.861 0.362 . . . . 0.0 111.086 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 15.3 tt -146.34 142.79 21.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.762 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -96.77 118.31 32.94 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.131 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.403 ' O ' HG23 ' A' ' 90' ' ' VAL . 9.5 mt -97.4 -6.82 33.18 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.413 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 9.3 t-20 -45.06 -28.7 0.74 Allowed 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -178.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.9 m -80.59 -40.67 25.34 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.46 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 2.7 m -72.8 -50.82 30.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 113.067 0.765 . . . . 0.0 113.067 -178.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.46 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -82.93 147.35 5.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.137 0.494 . . . . 0.0 111.461 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.406 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 4.9 tt0 -138.96 166.83 23.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.96 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -108.02 99.91 9.3 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.059 0.457 . . . . 0.0 110.743 -179.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.2 t -99.17 96.88 5.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.848 179.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.0 t0 52.6 33.67 14.1 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.37 28.35 11.72 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.579 -0.82 . . . . 0.0 113.3 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -140.99 134.11 29.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.907 0.384 . . . . 0.0 111.2 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.406 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 59.3 mt -73.5 119.56 17.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.529 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 2.3 mmmt -125.18 141.75 51.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.194 0.521 . . . . 0.0 111.985 -179.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.451 ' CD2' ' CE1' ' A' ' 40' ' ' HIS . 46.1 t80 -78.36 -32.06 48.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.659 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.94 179.969 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.52 -0.232 . . . . 0.0 112.52 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 52.1 tp -139.34 97.89 3.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.745 0.307 . . . . 0.0 110.986 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 61.65 -105.74 0.99 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.532 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 51.7 mttt 62.99 70.01 0.56 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.928 0.394 . . . . 0.0 111.121 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.447 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 31.0 p90 -92.66 -38.97 11.56 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.127 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.408 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 6.8 tp -63.87 -17.63 20.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.736 0.303 . . . . 0.0 111.161 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.62 -26.47 54.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.959 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.0 p -118.67 18.59 13.4 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.183 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.3 m -134.41 154.91 51.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.968 0.413 . . . . 0.0 111.063 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.412 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 1.6 ptm180 -134.25 172.8 12.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.19 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.412 ' OD1' ' O ' ' A' ' 9' ' ' ARG . 6.3 p-10 49.04 57.4 6.5 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.3 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.2 p -79.58 134.14 36.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.88 178.493 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -158.35 163.66 37.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.388 -179.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.468 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.31 135.85 38.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.156 0.503 . . . . 0.0 110.73 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.28 146.12 46.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.085 179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.78 -153.33 25.31 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.814 -1.184 . . . . 0.0 111.408 -179.021 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.0 -36.85 19.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -141.04 36.23 1.74 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -116.05 146.09 42.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.168 0.509 . . . . 0.0 111.881 179.172 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 15.2 tp -120.89 125.07 46.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.175 178.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.6 143.93 47.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.858 0.361 . . . . 0.0 110.031 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.28 172.51 16.51 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.386 -178.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.15 133.54 54.23 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.2 m -130.77 132.82 45.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.158 0.504 . . . . 0.0 112.043 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.1 ptpt -66.52 135.73 54.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.105 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.0 p -85.89 -176.28 5.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.633 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.1 mtt-85 -61.46 -29.91 70.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.742 0.306 . . . . 0.0 111.257 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.76 8.86 9.0 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 66.53 37.06 4.69 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.169 0.509 . . . . 0.0 111.059 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.41 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.0 OUTLIER -118.24 136.33 53.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.995 178.103 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -92.64 125.47 37.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.921 0.391 . . . . 0.0 111.858 -178.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.1 m -129.87 152.56 37.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.828 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.4 t -72.75 133.54 44.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.178 0.513 . . . . 0.0 111.592 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -142.11 161.37 38.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.272 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -142.5 154.99 45.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.407 0.622 . . . . 0.0 112.206 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -136.41 124.87 36.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.821 179.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -88.64 120.29 29.9 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.683 0.278 . . . . 0.0 111.036 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.5 mp -88.05 -14.52 38.73 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.5 p-10 -57.49 -45.06 85.34 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -178.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.8 OUTLIER -92.3 -10.53 38.03 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 122.106 -0.371 . . . . 0.0 111.569 179.434 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -98.12 -65.56 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.421 HD13 ' CD1' ' A' ' 50' ' ' TRP . 15.7 mm -80.48 150.16 4.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.708 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.415 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.18 172.29 12.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.726 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.474 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 24.9 t30 -112.71 110.57 20.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.373 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.8 mm -110.86 89.62 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.042 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.4 t70 68.71 39.19 2.04 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.908 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.75 0.66 90.29 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.978 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.1 m -110.53 136.74 49.19 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.933 0.397 . . . . 0.0 110.858 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.9 mt -77.08 116.31 17.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.544 0.687 . . . . 0.0 111.012 -178.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 31.4 mttt -135.25 161.92 34.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.015 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.432 ' CE2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -86.58 119.15 26.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.938 0.399 . . . . 0.0 111.19 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.419 ' O ' ' N ' ' A' ' 53' ' ' SER . 1.3 tp-100 -175.51 141.56 0.64 Allowed Pre-proline 0 C--N 1.331 -0.208 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.201 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.41 ' HD2' ' HG3' ' A' ' 51' ' ' GLN . 17.9 Cg_endo -61.47 76.17 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.265 1.977 . . . . 0.0 112.781 -179.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -166.89 135.41 2.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.665 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.08 108.99 15.99 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 25.4 p90 -49.51 -31.0 9.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.761 178.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.1 p -48.9 -16.77 0.14 Allowed 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -179.122 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -63.27 -29.53 70.84 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.15 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.474 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -128.89 1.86 5.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.286 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.7 m -112.79 147.93 35.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.244 0.545 . . . . 0.0 111.864 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 26.6 p90 -143.21 157.74 44.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.929 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 63.32 44.24 5.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.006 0.432 . . . . 0.0 110.485 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.5 m -69.08 137.14 53.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.466 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.87 152.89 42.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.596 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.468 HG13 ' HB2' ' A' ' 13' ' ' LEU . 33.8 mt -129.72 140.44 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-O 121.288 0.566 . . . . 0.0 111.805 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -136.19 108.55 7.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.791 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.93 -120.84 12.97 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.431 -0.89 . . . . 0.0 111.243 -178.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.9 p -101.72 -3.67 27.78 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -179.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.1 t -101.88 139.23 23.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.977 0.418 . . . . 0.0 111.756 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.6 tp -100.93 125.12 47.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.332 179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.6 m -115.6 123.49 48.56 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.2 t -151.92 153.83 34.91 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.41 -178.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.498 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 6.3 m -94.18 125.78 39.02 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 88.0 m -126.01 143.95 50.9 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -74.13 136.84 42.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.753 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 12.5 mtp-105 -92.15 144.21 25.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.724 0.297 . . . . 0.0 110.503 179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.2 m -52.06 -27.12 12.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.749 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -83.56 2.39 37.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.617 0.246 . . . . 0.0 111.651 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.73 136.26 7.07 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.687 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.62 -169.6 12.99 Favored Glycine 0 C--N 1.318 -0.434 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 -178.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -130.0 142.05 50.67 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.266 0.533 . . . . 0.0 111.123 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -153.79 128.74 9.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.203 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.498 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.7 t -93.12 134.69 35.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.607 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.3 p -122.9 158.35 30.56 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.443 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 14.9 m -122.71 145.64 48.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.902 0.382 . . . . 0.0 111.201 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.9 tt -145.33 143.72 21.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.812 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -97.1 116.29 29.04 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.745 179.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.41 ' O ' HG23 ' A' ' 90' ' ' VAL . 11.2 mt -97.62 -4.54 37.32 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.442 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 12.4 t-20 -44.92 -27.72 0.57 Allowed 'General case' 0 N--CA 1.466 0.342 0 O-C-N 122.155 -0.341 . . . . 0.0 111.874 -178.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.5 -41.28 21.95 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.446 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.5 m -72.67 -52.33 23.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.447 ' HB ' ' CD1' ' A' ' 4' ' ' PHE . 3.0 mp -83.13 147.37 5.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.103 0.477 . . . . 0.0 111.279 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.47 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 16.9 tt0 -139.92 167.09 22.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.14 -178.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -107.37 99.9 9.38 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.101 0.477 . . . . 0.0 110.805 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 58.8 t -98.53 97.48 6.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.007 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.7 t0 53.07 33.74 15.65 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.27 28.31 11.9 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.662 -0.78 . . . . 0.0 113.111 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.7 m -141.58 135.7 30.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.871 0.367 . . . . 0.0 111.279 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.47 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 63.0 mt -74.24 120.48 19.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.801 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 14.7 mttt -123.87 137.46 54.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.36 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.425 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 34.9 t80 -82.25 -28.38 31.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.791 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.287 -0.864 . . . . 0.0 110.903 179.871 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . 0.406 ' O ' ' N ' ' A' ' 2' ' ' GLY . . . . . . . . 0 N--CA 1.489 2.204 0 N-CA-C 112.597 -0.201 . . . . 0.0 112.597 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 48.5 mt 62.56 -78.37 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.821 0.343 . . . . 0.0 110.934 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' -1' ' ' GLY . . . -141.06 -86.28 0.1 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.408 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 29.1 mttt 63.3 71.15 0.51 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.96 0.41 . . . . 0.0 110.748 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.2 p90 -92.15 -37.0 12.99 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.348 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.403 ' O ' HG13 ' A' ' 5' ' ' ILE . 5.8 tp -67.7 -11.74 14.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.365 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -76.74 -26.08 54.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.834 0.35 . . . . 0.0 110.552 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.0 p -118.37 -3.35 10.97 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.447 179.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 70.6 m -108.11 150.6 26.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.126 0.488 . . . . 0.0 111.402 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.401 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.4 ptm180 -131.87 172.47 12.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.506 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.406 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.8 p-10 49.45 56.97 7.02 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.062 0.458 . . . . 0.0 111.685 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 8.3 p -79.32 132.59 36.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.691 178.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.6 pt20 -158.14 163.89 37.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.44 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.432 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.31 136.38 37.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.028 -179.624 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.81 143.59 47.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.163 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.07 -152.27 33.03 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 119.78 -1.2 . . . . 0.0 111.324 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.23 -36.74 19.23 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.442 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.1 p -140.9 34.96 1.76 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -178.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -115.22 148.8 38.66 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.073 0.463 . . . . 0.0 111.662 178.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.414 ' HB2' ' CD1' ' A' ' 64' ' ' ILE . 12.6 tp -122.97 124.9 44.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.346 179.231 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.06 144.15 46.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.3 172.48 16.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.117 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -116.51 133.38 56.09 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 177.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 17.2 m -130.73 136.77 49.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.027 0.441 . . . . 0.0 111.893 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.3 ptpt -66.74 137.9 56.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.481 -179.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 75.2 p -86.44 -175.78 5.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.879 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -61.64 -31.41 71.51 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 111.523 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.63 9.61 9.14 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 66.84 39.7 3.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.274 0.559 . . . . 0.0 111.381 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.417 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 74.8 mt-30 -118.82 136.65 53.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.664 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -93.77 124.82 38.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.898 0.38 . . . . 0.0 111.641 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.7 m -131.5 148.92 32.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.584 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 73.3 m -71.5 138.57 49.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.328 0.585 . . . . 0.0 112.044 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.6 t -143.94 161.25 39.19 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.18 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmmm? -139.87 154.61 47.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.396 0.617 . . . . 0.0 112.42 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.401 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.3 tp -137.78 125.08 29.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.048 -0.978 . . . . 0.0 108.925 179.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -88.97 120.61 30.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.728 0.299 . . . . 0.0 111.071 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.6 mp -88.98 -15.75 33.41 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.982 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.3 p-10 -57.82 -43.06 85.48 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -178.407 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.43 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 7.9 p-10 -92.77 -11.34 34.06 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 122.135 -0.353 . . . . 0.0 111.493 179.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.436 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 22.9 m-70 -97.61 -65.95 0.93 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.412 ' N ' ' CD1' ' A' ' 41' ' ' ILE . 2.1 mp -80.77 148.78 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.172 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -141.3 170.84 14.96 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.116 -179.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.426 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 19.4 t30 -113.03 113.23 25.17 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.926 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.419 ' N ' ' CD1' ' A' ' 44' ' ' ILE . 2.4 mp -113.16 89.44 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.028 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 69.62 36.83 2.05 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.006 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.81 1.31 85.25 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.695 -0.764 . . . . 0.0 113.467 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 18.1 m -111.69 135.81 51.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 117.252 0.526 . . . . 0.0 111.255 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.3 mt -77.59 116.92 18.54 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.648 0.737 . . . . 0.0 111.599 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.4 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 9.8 mttm -137.82 162.74 33.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.921 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.463 ' CH2' ' CD1' ' A' ' 85' ' ' ILE . 11.6 m-90 -87.02 121.8 29.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.882 0.372 . . . . 0.0 111.184 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.426 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 35.2 tt0 -175.6 144.75 0.77 Allowed Pre-proline 0 N--CA 1.464 0.231 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.984 -179.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.43 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 29.9 Cg_endo -64.45 71.56 0.21 Allowed 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.084 1.856 . . . . 0.0 112.785 -179.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 51' ' ' GLN . 4.0 p -162.86 133.31 4.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.527 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -81.07 110.18 16.35 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -177.869 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.405 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 37.8 p90 -48.83 -29.38 4.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.402 178.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 74.8 p -48.65 -19.08 0.31 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.843 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -61.58 -30.49 70.71 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.34 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.426 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -127.96 -0.19 5.94 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.146 -0.222 . . . . 0.0 111.496 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -110.95 149.19 31.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.247 0.546 . . . . 0.0 112.292 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -143.02 157.43 44.55 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.102 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 64.03 46.52 3.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.003 0.43 . . . . 0.0 110.536 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 26.9 m -69.51 136.7 51.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.71 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.27 151.56 42.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.686 -179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.432 HG13 ' HB2' ' A' ' 13' ' ' LEU . 37.5 mt -130.6 139.04 52.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.354 0.597 . . . . 0.0 111.738 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -136.44 111.08 8.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.21 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.49 -121.26 17.14 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.161 -1.019 . . . . 0.0 110.934 -178.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.0 p -101.07 -3.88 28.44 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.7 t -101.67 138.43 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.9 tp -102.56 123.78 46.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.127 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.3 m -114.48 125.86 54.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 t -151.57 153.83 35.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.774 0.321 . . . . 0.0 111.494 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 8.5 m -93.91 126.18 38.96 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 82.7 m -126.03 142.74 51.39 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -75.58 140.1 42.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.799 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -92.82 143.51 26.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.686 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 37.3 m -51.94 -29.78 21.78 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.753 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.47 3.02 29.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.578 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.79 134.68 6.9 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.793 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 118.27 -174.77 15.43 Favored Glycine 0 C--N 1.318 -0.448 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -178.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -129.34 141.74 51.0 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 117.356 0.578 . . . . 0.0 110.845 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -153.95 130.31 10.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.424 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.515 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.1 t -92.51 134.49 34.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.48 -179.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.8 p -121.42 157.88 29.56 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.901 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -123.14 146.2 47.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.866 0.365 . . . . 0.0 111.301 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.463 ' CD1' ' CH2' ' A' ' 50' ' ' TRP . 15.7 tt -146.43 143.3 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.869 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -95.98 117.02 29.82 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.848 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.1 mt -96.1 -5.19 41.39 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -178.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -44.73 -27.63 0.52 Allowed 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.1 m -81.1 -39.67 25.31 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.464 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.1 m -73.49 -53.43 18.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -177.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.464 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.89 147.13 6.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.175 0.512 . . . . 0.0 112.042 -178.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.436 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 12.5 tt0 -138.96 166.17 25.18 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.923 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -107.58 99.75 9.22 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.193 0.52 . . . . 0.0 110.767 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.6 t -97.93 96.98 5.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.745 179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 22.3 t0 54.07 33.11 16.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.704 0.288 . . . . 0.0 111.56 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.56 28.45 12.67 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 120.723 -0.751 . . . . 0.0 113.223 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 68.0 p -140.33 135.94 32.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.898 0.38 . . . . 0.0 111.219 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.436 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 31.2 mt -74.21 119.35 18.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.067 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.1 mttt -124.29 138.25 54.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.447 -179.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.436 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 32.5 t80 -79.23 150.21 31.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.01 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.405 ' N ' ' O ' ' A' ' 90' ' ' VAL . 11.7 tt0 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.191 -0.909 . . . . 0.0 111.081 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 112.537 -0.225 . . . . 0.0 112.537 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 10.1 tp -96.45 159.08 15.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.863 0.363 . . . . 0.0 110.978 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -65.32 -85.7 0.07 OUTLIER Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.744 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.3 mttt 65.58 72.73 0.41 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.763 0.316 . . . . 0.0 110.909 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.421 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 19.7 p90 -95.8 -38.0 10.5 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.444 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.414 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 3.8 tp -65.5 -14.43 16.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.707 0.289 . . . . 0.0 111.129 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 mp0 -76.33 -27.23 56.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.786 0.327 . . . . 0.0 110.528 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.3 p -119.23 19.1 12.92 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.181 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.9 m -131.35 154.86 48.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.136 0.494 . . . . 0.0 111.771 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -134.93 173.07 12.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.065 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 p30 49.32 57.12 6.83 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 p -79.54 130.55 35.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.63 178.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -156.43 163.26 39.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.64 -179.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.417 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.98 136.6 38.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.187 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.88 143.17 48.08 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.462 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.3 -150.1 37.93 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.025 -1.083 . . . . 0.0 111.82 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.69 -37.1 18.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.454 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -143.23 35.64 1.35 Allowed 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -114.43 146.57 40.45 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.815 0.34 . . . . 0.0 111.484 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.9 tp -120.29 123.21 42.6 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.18 144.63 47.6 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.56 172.55 16.17 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.876 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -112.3 134.31 53.91 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 177.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.0 m -130.46 134.83 47.4 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.39 -0.524 . . . . 0.0 112.228 -178.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 6.3 ptpt -67.3 135.51 53.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.326 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 64.1 p -85.16 -179.33 6.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.27 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 45.8 mtt-85 -59.3 -29.69 67.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.559 -179.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.79 10.68 8.94 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 66.9 39.27 3.39 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.025 0.441 . . . . 0.0 112.005 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -121.44 132.63 54.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.419 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 46.8 m-85 -90.65 126.46 35.98 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.108 0.48 . . . . 0.0 111.922 -178.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.1 m -131.06 151.61 36.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.793 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 41.5 m -71.06 134.6 47.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.228 0.537 . . . . 0.0 111.948 -178.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.3 t -142.11 161.82 37.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.284 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.11 156.02 45.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.321 0.582 . . . . 0.0 112.394 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -138.46 125.0 25.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.113 -0.949 . . . . 0.0 108.774 179.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -87.17 115.92 24.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.649 0.261 . . . . 0.0 111.199 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.1 mp -87.17 -16.29 35.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.391 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.86 -45.84 74.62 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.64 0.257 . . . . 0.0 111.467 -178.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.47 -10.4 37.96 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.401 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 28.6 m-70 -97.86 -65.9 0.93 Allowed 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.423 ' N ' ' CD1' ' A' ' 41' ' ' ILE . 1.9 mp -80.03 149.29 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.295 178.755 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -141.36 172.68 12.35 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.933 -179.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.438 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 20.0 t30 -112.72 112.27 23.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.219 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.1 mp -111.85 93.46 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-O 120.865 0.364 . . . . 0.0 110.805 179.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 38.3 t0 64.78 39.64 6.07 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.206 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.28 1.83 90.38 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.562 -0.828 . . . . 0.0 113.123 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 20.9 m -112.46 137.13 51.11 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 117.187 0.494 . . . . 0.0 111.004 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 66.3 mt -77.72 118.55 20.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.433 0.635 . . . . 0.0 112.326 -177.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 37.5 mttt -139.65 163.34 32.84 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.101 179.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.433 ' CE2' HG12 ' A' ' 90' ' ' VAL . 9.8 m-90 -87.1 121.71 29.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 111.637 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.451 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 38.5 tt0 -175.26 145.3 0.85 Allowed Pre-proline 0 N--CA 1.466 0.332 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.909 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.451 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 37.1 Cg_endo -65.25 71.26 0.28 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.267 1.978 . . . . 0.0 112.797 -179.06 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.1 p -162.48 133.19 4.84 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.47 179.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.16 112.4 18.47 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.247 0.546 . . . . 0.0 112.457 -177.634 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.45 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 49.3 p90 -51.56 -30.39 20.56 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.952 178.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.7 p -50.87 -17.36 0.55 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -62.07 -29.46 70.32 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.042 -0.263 . . . . 0.0 110.634 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.438 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -129.04 0.66 5.25 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.664 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.5 m -112.16 147.96 35.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.112 0.482 . . . . 0.0 112.06 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -141.71 157.39 45.11 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.24 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 63.49 44.89 5.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.105 0.479 . . . . 0.0 110.456 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 70.7 m -68.51 137.0 54.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.663 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.62 152.6 41.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.822 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.476 HD12 HG22 ' A' ' 64' ' ' ILE . 58.3 mt -130.94 140.74 47.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.337 0.589 . . . . 0.0 111.628 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -137.78 109.48 7.07 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.652 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.89 -122.43 13.49 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.675 -178.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.4 p -101.78 -2.8 29.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 117.012 0.406 . . . . 0.0 112.085 -179.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 t -102.54 137.3 31.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-O 120.957 0.408 . . . . 0.0 111.752 179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.5 tp -100.89 124.08 46.04 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.349 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.1 m -114.24 125.5 53.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.111 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.7 t -151.58 153.59 34.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.794 0.331 . . . . 0.0 111.722 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.1 m -94.42 126.02 39.43 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.3 m -127.7 145.32 50.94 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -178.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -74.86 138.03 42.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.477 177.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 56.4 mtp180 -91.09 142.98 27.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.555 0.217 . . . . 0.0 110.532 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 62.7 m -52.1 -25.13 8.06 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.694 0.283 . . . . 0.0 111.554 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -84.13 1.57 43.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.387 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.42 135.83 7.21 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.839 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.06 -167.34 12.3 Favored Glycine 0 C--N 1.32 -0.335 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -131.99 141.49 49.29 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 117.329 0.564 . . . . 0.0 111.594 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -153.99 129.89 10.19 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.454 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.6 t -92.13 135.18 34.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.737 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.2 p -121.88 158.33 29.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.203 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 4.5 p -121.87 145.65 47.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.797 0.332 . . . . 0.0 111.104 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.416 HD12 ' CZ3' ' A' ' 50' ' ' TRP . 13.2 tt -144.42 143.32 23.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.647 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -97.15 117.6 31.7 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.781 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 6.8 mt -99.4 -4.61 31.16 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -178.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.414 ' ND2' ' CG2' ' A' ' 5' ' ' ILE . 10.7 t-20 -44.82 -29.1 0.73 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -178.358 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.7 m -81.32 -41.67 21.73 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.433 HG12 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -70.58 -52.76 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -177.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.432 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.8 mp -83.33 147.59 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.913 0.387 . . . . 0.0 111.543 -179.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.405 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 31.3 tt0 -138.51 165.57 26.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.22 -179.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -105.96 99.53 9.11 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 121.183 0.516 . . . . 0.0 110.766 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 47.8 t -97.54 97.12 5.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.538 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.0 t0 53.19 33.29 14.95 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.763 0.282 . . . . 0.0 111.763 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.5 28.63 11.13 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.752 -0.737 . . . . 0.0 113.253 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.28 135.24 30.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.931 0.396 . . . . 0.0 110.971 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.405 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 79.2 mt -74.01 119.86 18.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.803 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -123.02 131.03 53.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.417 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.422 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 14.2 t80 -84.06 -45.8 12.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.147 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.289 -0.862 . . . . 0.0 111.103 -179.986 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.203 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -158.43 128.37 5.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.669 0.271 . . . . 0.0 110.838 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 154.73 148.58 5.02 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.617 -0.802 . . . . 0.0 112.736 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.3 ptpt -152.15 86.22 1.29 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.766 0.317 . . . . 0.0 111.171 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.413 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 13.6 p90 -93.11 -40.61 10.41 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.296 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.402 ' CB ' ' HB3' ' A' ' 67' ' ' SER . 8.0 tp -63.04 -20.04 24.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.449 -179.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -77.64 -25.51 49.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.784 0.326 . . . . 0.0 110.552 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.0 p -118.4 16.66 13.87 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.849 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.3 m -134.13 155.7 49.61 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.99 0.424 . . . . 0.0 111.37 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.41 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.9 ptt180 -132.29 172.9 11.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.945 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.438 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.2 p-10 49.52 57.46 6.48 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.239 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 19.3 p -78.94 132.15 36.62 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -157.66 163.85 37.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.616 -179.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.444 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.5 OUTLIER -97.21 136.52 37.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.037 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.9 143.63 47.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.134 179.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.15 -152.19 33.51 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 119.849 -1.167 . . . . 0.0 111.534 -178.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.47 -37.01 18.71 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -178.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -141.25 35.65 1.7 Allowed 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -115.69 146.74 41.59 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.156 0.503 . . . . 0.0 111.833 178.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.415 ' HB2' HD12 ' A' ' 37' ' ' LEU . 13.3 tp -119.09 124.13 46.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.321 179.023 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.85 143.19 47.12 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.09 172.24 17.15 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.33 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -112.17 133.65 54.18 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 83.7 m -130.97 134.56 46.84 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.2 ptpt -67.03 136.02 54.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.241 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 75.8 p -85.77 -177.81 6.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.272 179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.8 mmp_? -61.26 -29.32 69.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.87 0.366 . . . . 0.0 110.794 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.44 8.72 8.71 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 66.56 36.35 4.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.262 0.553 . . . . 0.0 111.037 -178.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 25.2 mt-30 -118.53 136.93 53.55 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.862 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -93.06 124.76 37.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.909 0.385 . . . . 0.0 111.702 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.2 m -129.98 149.72 33.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.619 179.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.2 p -71.02 135.06 47.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.185 0.517 . . . . 0.0 111.88 -178.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.9 t -142.51 161.42 38.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.253 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -142.35 156.72 45.26 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.394 0.616 . . . . 0.0 112.371 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.416 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.1 tp -139.52 125.18 21.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.087 179.335 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -87.66 120.35 28.89 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.663 0.268 . . . . 0.0 111.289 -178.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.415 HD12 ' HB2' ' A' ' 19' ' ' LEU . 4.2 mp -88.35 -15.29 36.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.825 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.428 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.6 p-10 -57.51 -43.36 84.19 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 5.1 p30 -92.48 -10.58 37.31 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 122.077 -0.389 . . . . 0.0 111.848 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -99.51 -63.33 1.13 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.462 ' N ' ' CD1' ' A' ' 41' ' ' ILE . 1.5 mp -79.64 147.16 6.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.791 178.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.406 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -140.41 170.05 16.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.654 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.446 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 27.1 t30 -113.21 111.79 22.66 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.292 -179.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.416 ' CD1' ' HB2' ' A' ' 49' ' ' LYS . 2.3 mp -112.37 89.56 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.529 179.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.3 t70 68.52 38.81 2.27 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.042 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.95 0.83 90.52 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.624 -0.798 . . . . 0.0 113.426 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.8 m -108.72 135.33 50.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 117.334 0.567 . . . . 0.0 110.507 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.0 mt -77.49 117.0 18.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.65 0.738 . . . . 0.0 111.693 -177.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.416 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 10.3 mttm -138.3 163.26 32.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.577 179.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.455 ' O ' ' CG ' ' A' ' 51' ' ' GLN . 9.1 m-90 -88.03 122.4 31.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.856 0.36 . . . . 0.0 111.791 -179.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.455 ' CG ' ' O ' ' A' ' 50' ' ' TRP . 26.4 mt-30 -171.16 149.81 2.73 Favored Pre-proline 0 N--CA 1.47 0.53 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.65 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -69.74 66.48 1.76 Allowed 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 121.831 1.687 . . . . 0.0 112.035 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.406 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.2 p -157.7 134.57 9.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.967 -1.015 . . . . 0.0 108.732 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -81.54 109.88 16.41 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -178.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.414 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 38.4 p90 -48.45 -29.73 4.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.576 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.2 p -48.36 -19.36 0.3 Allowed 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -62.46 -24.82 67.65 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.499 -178.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.446 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -133.3 2.4 3.55 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.4 m -112.58 148.53 34.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.13 0.49 . . . . 0.0 112.318 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -139.97 155.51 47.09 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.942 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 64.19 49.63 2.59 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.953 0.406 . . . . 0.0 111.103 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 44.9 m -71.34 135.2 47.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.788 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.85 151.93 41.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.507 179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.444 HG13 ' HB2' ' A' ' 13' ' ' LEU . 38.1 mt -129.94 140.49 48.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.27 0.557 . . . . 0.0 111.848 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -136.6 110.63 8.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.507 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.32 -121.87 16.71 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.224 -0.989 . . . . 0.0 110.887 -178.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.402 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.6 p -101.54 -3.21 28.9 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 9.0 t -102.86 140.7 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 120.985 0.421 . . . . 0.0 111.814 179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.2 tp -102.85 126.79 50.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.498 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 5.6 m -115.21 124.23 50.87 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 t -151.78 153.64 34.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.742 0.306 . . . . 0.0 111.288 -178.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.48 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.8 m -94.42 125.7 39.23 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 75.2 m -126.16 143.41 51.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.435 0.636 . . . . 0.0 112.514 -178.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -75.7 139.53 41.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.89 178.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 47.8 mtp85 -93.55 144.63 25.19 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.754 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.6 m -51.85 -28.39 15.76 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.786 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -83.15 1.98 37.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.497 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.2 136.69 7.48 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.778 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.7 -170.78 13.51 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -131.22 141.85 50.09 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.238 0.519 . . . . 0.0 111.121 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 41.0 t30 -154.14 129.49 9.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.347 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.48 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.2 t -92.72 134.78 34.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.714 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.4 p -121.83 158.48 28.82 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.546 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 46.0 m -121.9 143.96 49.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.359 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.6 tt -145.11 143.08 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.843 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -96.97 116.26 28.88 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.035 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 9.8 mt -97.44 -6.83 33.04 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.413 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 7.4 t-20 -45.1 -27.53 0.6 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -178.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 61.7 m -81.88 -41.15 21.37 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.455 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 2.9 m -71.65 -51.18 34.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -178.056 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.455 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.8 mp -82.8 147.51 5.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.965 0.412 . . . . 0.0 111.182 -179.172 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -138.38 166.58 23.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.04 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -107.64 99.77 9.23 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.074 0.464 . . . . 0.0 110.629 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.5 t -98.36 97.11 5.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.868 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 34.2 t0 52.83 33.2 13.75 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 179.872 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.24 28.72 11.2 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.581 -0.819 . . . . 0.0 113.371 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 54.1 p -141.1 134.96 30.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.925 0.393 . . . . 0.0 111.289 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.416 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 41.1 mt -73.31 119.16 17.16 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.681 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.3 mttm -125.21 139.32 53.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.639 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -80.64 -53.78 6.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.59 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.211 -0.9 . . . . 0.0 110.769 179.746 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.446 -0.261 . . . . 0.0 112.446 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.0 tt -109.12 -61.6 1.6 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.817 0.342 . . . . 0.0 110.972 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -71.83 148.68 43.55 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.873 -0.679 . . . . 0.0 112.843 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.2 mtmt -150.62 82.73 1.35 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.865 0.364 . . . . 0.0 110.442 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.446 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 15.6 p90 -91.16 -40.4 11.59 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.855 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.413 ' CB ' ' HB3' ' A' ' 67' ' ' SER . 8.0 tp -61.77 -20.76 24.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.663 0.268 . . . . 0.0 111.618 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -75.92 -23.92 55.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.198 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.0 p -118.17 8.43 12.36 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 m -125.39 154.86 41.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.077 0.465 . . . . 0.0 111.226 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.2 173.18 11.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.814 -179.766 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.416 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.8 p-10 49.18 58.13 5.72 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.005 0.431 . . . . 0.0 112.152 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 9.9 p -79.57 131.98 36.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.784 178.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -157.45 163.72 38.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.448 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.468 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.37 136.72 37.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.841 -179.65 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.85 143.9 47.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.435 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.35 -151.01 36.49 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 119.927 -1.13 . . . . 0.0 111.522 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.28 -37.2 18.8 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.455 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.18 35.86 1.53 Allowed 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -114.36 149.99 35.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.02 0.438 . . . . 0.0 111.806 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.3 tp -123.56 124.22 42.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.546 179.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.42 144.31 47.01 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.865 0.364 . . . . 0.0 110.196 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.38 172.24 16.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.373 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -111.52 134.12 53.31 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 64.2 m -131.01 132.32 44.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.141 0.496 . . . . 0.0 112.103 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.423 ' HB3' ' CE2' ' A' ' 30' ' ' PHE . 1.9 ptpt -66.41 136.93 56.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.219 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 82.6 p -85.86 -178.47 6.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.481 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 29.9 mtt180 -60.82 -30.06 69.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.766 0.317 . . . . 0.0 111.03 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.78 9.06 8.6 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 66.96 37.32 3.93 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.145 0.497 . . . . 0.0 111.635 -178.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -118.5 135.46 54.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.009 177.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.423 ' CE2' ' HB3' ' A' ' 24' ' ' LYS . 77.5 m-85 -92.34 124.61 36.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.994 0.426 . . . . 0.0 111.879 -178.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.6 m -129.88 148.24 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.295 179.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.4 t -70.14 136.49 50.18 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.305 0.574 . . . . 0.0 111.814 -178.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.7 t -143.14 161.53 37.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.994 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.3 ttpt -142.6 157.12 45.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.289 0.566 . . . . 0.0 111.901 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -138.6 127.13 29.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.29 179.592 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -87.68 117.02 26.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.629 0.252 . . . . 0.0 111.511 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.2 mp -86.11 -16.18 38.8 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.61 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -55.08 -48.03 74.09 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.886 -178.625 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.444 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.6 OUTLIER -92.08 -10.06 40.42 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 122.26 -0.275 . . . . 0.0 111.508 179.536 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.415 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 23.4 m-70 -96.5 -69.54 0.75 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.433 ' N ' ' CD1' ' A' ' 41' ' ' ILE . 1.8 mp -79.34 151.36 4.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.137 178.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.404 ' CB ' ' OG ' ' A' ' 53' ' ' SER . . . -141.74 172.38 12.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.956 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.487 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 23.2 t30 -112.82 113.1 25.04 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.971 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.426 ' CD1' ' HB2' ' A' ' 49' ' ' LYS . 2.6 mp -113.25 89.95 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.818 0.342 . . . . 0.0 111.327 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 39.6 t0 69.32 38.77 1.78 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.587 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.15 3.37 88.97 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 120.598 -0.81 . . . . 0.0 113.061 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 52.1 m -115.89 137.4 52.14 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.944 0.402 . . . . 0.0 111.124 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.9 mt -77.45 116.64 18.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.569 0.699 . . . . 0.0 111.925 -177.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.426 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 38.3 mttt -137.22 162.56 33.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.701 -1.136 . . . . 0.0 109.527 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.448 ' CE2' HG13 ' A' ' 90' ' ' VAL . 6.1 m-90 -87.67 124.1 33.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.103 0.478 . . . . 0.0 112.062 -179.063 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.421 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 12.6 tt0 -176.33 149.72 0.97 Allowed Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.179 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.444 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 12.3 Cg_exo -67.94 66.15 0.93 Allowed 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.27 1.98 . . . . 0.0 112.485 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.404 ' OG ' ' CB ' ' A' ' 42' ' ' ALA . 3.1 p -155.92 135.44 12.44 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.726 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.435 ' ND2' ' N ' ' A' ' 54' ' ' ASN . 0.0 OUTLIER -82.62 106.6 14.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.216 0.532 . . . . 0.0 112.313 -177.701 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.455 ' CZ ' ' CB ' ' A' ' 17' ' ' SER . 33.8 p90 -47.78 -30.18 3.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.532 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.6 p -49.35 -18.03 0.33 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.893 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -64.78 -26.93 68.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.569 0.223 . . . . 0.0 111.6 -178.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.487 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.3 p -128.68 -3.42 5.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.558 0.218 . . . . 0.0 111.485 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 72' ' ' THR . 4.8 m -109.2 148.96 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.207 0.527 . . . . 0.0 111.894 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.4 p90 -142.23 157.35 44.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.946 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.6 m-20 63.21 45.44 5.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.043 0.449 . . . . 0.0 110.75 -179.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.4 m -69.25 137.08 52.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.604 179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.38 151.17 43.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.489 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.468 HG13 ' HB2' ' A' ' 13' ' ' LEU . 24.3 mt -129.29 140.27 49.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.297 0.57 . . . . 0.0 111.823 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -136.77 108.92 7.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.238 -0.892 . . . . 0.0 108.98 179.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.75 -120.53 11.13 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.264 -0.97 . . . . 0.0 111.077 -178.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.413 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 20.6 p -103.33 -0.86 29.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.808 0.304 . . . . 0.0 111.514 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.7 t -103.61 139.11 25.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-O 120.934 0.397 . . . . 0.0 111.709 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 11.6 tp -103.94 124.9 49.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.345 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.3 m -114.86 125.22 53.41 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -152.13 153.88 34.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.625 0.25 . . . . 0.0 111.438 -178.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.4 m -94.26 125.8 39.11 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 96.1 m -123.87 142.38 51.17 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -73.7 137.31 43.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.873 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 18.7 mtm180 -91.45 142.39 27.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.694 0.283 . . . . 0.0 110.322 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.9 m -52.0 -28.99 18.87 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -83.73 3.82 31.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.656 0.265 . . . . 0.0 111.641 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.92 135.65 7.37 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.905 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.35 -171.95 14.0 Favored Glycine 0 C--N 1.319 -0.378 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -178.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -131.28 144.02 50.98 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 117.308 0.554 . . . . 0.0 111.263 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -154.2 129.53 9.77 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.302 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.522 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.6 t -92.54 134.88 34.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.74 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 81.3 p -122.35 158.07 30.43 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.317 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.9 m -122.9 144.06 49.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.871 0.367 . . . . 0.0 111.148 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.426 HD11 ' CZ2' ' A' ' 50' ' ' TRP . 13.5 tt -145.65 143.99 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.895 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -97.58 116.3 29.52 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.798 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.422 ' O ' HG21 ' A' ' 90' ' ' VAL . 6.0 mt -98.31 -6.64 30.53 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.446 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 6.8 t-20 -44.98 -27.98 0.61 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -178.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.0 t -81.93 -39.81 23.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.453 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.2 m -72.49 -52.08 25.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.453 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.53 147.64 5.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.007 0.432 . . . . 0.0 110.86 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 99' ' ' LYS . 10.9 tt0 -139.31 166.71 23.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.207 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -107.5 99.94 9.4 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.101 0.477 . . . . 0.0 110.662 -179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.7 t -100.38 97.96 6.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.04 179.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.1 t0 53.53 32.03 13.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.656 0.265 . . . . 0.0 111.672 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.93 28.55 10.85 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.619 -0.801 . . . . 0.0 113.369 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 36.1 t -140.93 134.45 29.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.902 0.382 . . . . 0.0 111.193 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.403 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 42.9 mt -73.01 119.51 17.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.75 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.413 ' O ' ' N ' ' A' ' 92' ' ' GLU . 26.2 mmtt -122.99 132.17 54.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.072 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.415 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 13.2 t80 -80.48 -34.13 36.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.61 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.327 -0.844 . . . . 0.0 111.069 179.76 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.217 0 N-CA-C 112.405 -0.278 . . . . 0.0 112.405 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.5 pp -88.09 125.28 34.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.837 0.351 . . . . 0.0 110.507 179.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 88.45 -125.57 7.74 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.064 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.9 mttt 60.56 51.08 5.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.762 0.315 . . . . 0.0 110.747 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.461 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 18.2 p90 -88.05 -41.06 13.34 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.075 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.431 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 8.3 tp -62.22 -22.31 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.778 0.323 . . . . 0.0 111.239 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -73.06 -24.43 60.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.832 0.349 . . . . 0.0 110.852 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.7 p -119.19 17.37 13.17 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.871 0.367 . . . . 0.0 111.723 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.9 m -133.21 155.28 49.63 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.0 0.428 . . . . 0.0 110.919 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.0 ptt85 -135.64 172.93 12.3 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.403 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.428 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.1 p-10 48.29 57.93 5.68 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.736 -0.666 . . . . 0.0 112.445 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 22.0 p -78.99 135.55 36.94 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.05 178.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -158.91 163.52 36.48 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.039 0.447 . . . . 0.0 111.678 -179.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.419 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.61 136.5 37.91 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.807 179.897 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.9 143.14 48.11 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.407 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.61 -149.14 33.4 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 119.944 -1.122 . . . . 0.0 111.887 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -87.3 -37.77 16.87 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -177.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.412 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.8 p -141.62 36.36 1.64 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -115.93 149.64 38.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.257 0.551 . . . . 0.0 111.976 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.419 ' N ' ' CD1' ' A' ' 37' ' ' LEU . 14.0 tp -123.49 123.79 41.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.768 178.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.91 142.68 47.07 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.64 172.78 15.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.523 -178.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -113.36 134.12 54.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 83.9 m -131.19 132.84 44.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.924 0.392 . . . . 0.0 111.82 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 5.2 ptpt -64.63 138.9 58.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.228 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 75.5 p -86.97 -176.87 5.9 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.506 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -61.02 -30.65 70.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.884 0.373 . . . . 0.0 111.277 -179.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.13 10.48 8.13 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -178.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 67.43 37.72 3.41 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.165 0.507 . . . . 0.0 111.216 -178.572 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -119.06 133.58 55.72 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.363 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.411 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 34.3 m-85 -91.3 125.42 36.06 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.115 0.483 . . . . 0.0 112.101 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.9 m -128.65 151.64 35.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.934 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.5 p -71.29 132.89 45.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.263 0.554 . . . . 0.0 111.784 -178.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.0 t -142.09 162.35 35.71 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.183 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.11 154.7 43.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.378 0.608 . . . . 0.0 111.85 -179.008 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.1 tp -135.76 125.78 41.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 179.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -88.02 117.49 26.93 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.952 -178.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.419 ' CD1' ' N ' ' A' ' 19' ' ' LEU . 3.4 mp -87.87 -15.87 35.53 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.0 p-10 -57.72 -44.86 86.28 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -177.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.444 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 3.5 m-20 -91.86 -9.97 41.42 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 122.047 -0.408 . . . . 0.0 111.247 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.437 ' CE1' ' HB2' ' A' ' 100' ' ' TYR . 14.3 m-70 -93.28 -63.55 1.2 Allowed 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.4 ' CD1' HD22 ' A' ' 87' ' ' LEU . 34.9 mt -83.05 154.03 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.965 178.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.403 ' CB ' ' HB2' ' A' ' 51' ' ' GLN . . . -142.0 171.89 13.44 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.257 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.407 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 25.8 t30 -112.6 111.36 22.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.618 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.449 ' N ' ' CD1' ' A' ' 44' ' ' ILE . 1.9 mp -111.7 88.56 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-O 121.05 0.452 . . . . 0.0 110.736 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 52.3 t0 67.91 39.39 2.58 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.16 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.1 2.68 90.56 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.741 -0.743 . . . . 0.0 113.348 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.6 m -109.92 136.38 49.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.199 0.499 . . . . 0.0 111.264 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 23.6 mt -77.1 116.29 17.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.701 0.762 . . . . 0.0 111.465 -178.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 41.3 mttt -139.43 163.52 32.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.684 179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.44 ' CZ2' HD11 ' A' ' 85' ' ' ILE . 9.5 m-90 -88.64 127.52 35.57 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.403 ' HB2' ' CB ' ' A' ' 42' ' ' ALA . 0.6 OUTLIER -174.46 151.96 1.65 Allowed Pre-proline 0 N--CA 1.469 0.519 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.539 -179.772 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.444 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 63.7 Cg_endo -74.12 66.17 5.2 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 121.945 1.763 . . . . 0.0 112.485 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -162.36 133.2 4.94 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.7 -1.136 . . . . 0.0 107.969 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.1 114.22 17.86 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -177.219 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.412 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 39.5 p90 -48.95 -29.24 4.56 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.386 177.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.6 p -49.83 -18.89 0.56 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.356 -178.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -60.8 -26.53 67.37 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.639 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.407 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.5 p -131.16 1.65 4.23 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.1 m -113.76 147.35 38.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.298 0.57 . . . . 0.0 112.481 -178.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.3 p90 -141.24 157.91 44.61 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.073 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 64.99 45.71 3.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.997 0.427 . . . . 0.0 111.39 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 46.4 m -67.82 135.51 52.69 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.639 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.56 151.8 41.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.561 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.419 HG13 ' HB2' ' A' ' 13' ' ' LEU . 48.3 mt -130.15 139.75 50.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.315 0.579 . . . . 0.0 111.907 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -134.05 109.09 8.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.932 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 65.59 -119.37 13.77 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.215 -0.993 . . . . 0.0 111.205 -178.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 19.4 p -101.53 -5.59 24.97 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.6 t -101.03 138.27 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 120.872 0.368 . . . . 0.0 111.583 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.7 tp -101.12 125.7 47.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.138 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.0 m -115.07 125.55 53.66 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.8 t -151.4 153.16 34.17 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.331 -178.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.4 m -93.91 126.0 38.86 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 89.7 m -126.58 144.6 50.84 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -73.36 134.99 44.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.48 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.0 mtp85 -92.09 142.88 27.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.647 0.26 . . . . 0.0 110.654 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 33.1 m -51.54 -28.2 13.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.67 -178.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -82.11 1.87 34.01 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.538 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.81 133.72 6.53 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.997 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.3 -167.48 12.5 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -130.89 142.15 50.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.797 0.298 . . . . 0.0 111.178 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -154.74 130.79 10.23 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.685 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.436 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -93.82 134.46 36.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.102 0.477 . . . . 0.0 111.574 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.3 p -120.67 158.93 26.36 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.636 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.3 p -123.92 145.85 48.86 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.859 0.361 . . . . 0.0 111.191 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.44 HD11 ' CZ2' ' A' ' 50' ' ' TRP . 15.2 tt -144.89 143.33 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.637 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -96.92 116.93 30.05 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.419 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.409 ' O ' HG22 ' A' ' 90' ' ' VAL . 6.9 mt -95.83 -4.71 43.28 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -178.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.461 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 11.9 t-20 -43.76 -29.31 0.51 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.289 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.3 m -81.77 -40.43 22.65 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.43 HG12 ' CZ2' ' A' ' 50' ' ' TRP . 3.5 m -70.86 -53.17 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.422 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -83.13 145.29 8.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.281 0.562 . . . . 0.0 112.052 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -135.75 165.49 25.47 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.942 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -107.18 99.84 9.35 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.971 0.415 . . . . 0.0 111.141 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 25.7 t -99.53 99.34 8.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.798 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.9 t0 53.08 32.09 12.39 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.773 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.15 28.83 10.26 Favored Glycine 0 C--N 1.329 0.144 0 C-N-CA 120.579 -0.82 . . . . 0.0 113.149 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 t -141.01 135.95 31.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.864 0.364 . . . . 0.0 111.029 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 67.5 mt -74.6 121.3 21.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.0 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -127.24 137.21 52.83 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-O 121.065 0.46 . . . . 0.0 112.202 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.437 ' HB2' ' CE1' ' A' ' 40' ' ' HIS . 35.8 t80 -75.95 -41.97 49.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.686 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.153 -0.927 . . . . 0.0 111.087 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.413 -0.275 . . . . 0.0 112.413 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.4 tt -105.25 129.92 53.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.804 0.335 . . . . 0.0 110.762 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 61.53 -105.52 0.92 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.457 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.2 mttt 60.61 66.75 0.89 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.855 0.36 . . . . 0.0 110.899 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.437 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 23.1 p90 -92.75 -38.26 11.9 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.312 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.406 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 7.3 tp -65.5 -15.68 19.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.696 0.284 . . . . 0.0 111.334 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -75.4 -25.24 57.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.764 0.316 . . . . 0.0 110.659 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.9 p -118.8 18.19 13.36 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.465 179.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.2 m -133.41 154.76 50.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.947 0.403 . . . . 0.0 111.441 -179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -133.69 172.74 12.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.174 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 49.0 57.77 6.09 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.209 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.2 p -79.39 133.11 36.57 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -157.76 163.77 37.75 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.399 -178.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.423 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.35 135.4 39.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.574 179.748 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -118.9 143.54 46.94 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.195 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.69 -151.49 33.06 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 119.891 -1.147 . . . . 0.0 111.465 -178.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.64 -37.19 18.27 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.087 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.8 35.24 1.78 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -115.91 146.96 41.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.017 0.437 . . . . 0.0 111.775 179.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.2 tp -119.75 124.91 47.35 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.89 143.58 47.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.922 0.392 . . . . 0.0 110.486 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.35 172.46 16.53 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.164 -178.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.33 133.88 54.18 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 177.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.6 m -130.54 133.16 46.01 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.255 0.55 . . . . 0.0 111.935 -178.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 4.5 ptpt -66.45 136.05 55.15 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.273 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 69.2 p -85.29 -177.59 6.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.577 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.0 mmt85 -60.8 -29.7 69.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.681 0.276 . . . . 0.0 111.263 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.11 9.32 10.67 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 66.68 37.84 4.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.159 0.504 . . . . 0.0 111.528 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.407 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 67.6 mt-30 -117.22 135.83 53.51 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -92.42 125.16 36.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 111.836 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 m -130.37 151.19 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.819 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.8 m -72.1 134.19 45.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.194 0.521 . . . . 0.0 111.558 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.2 t -142.68 161.45 38.05 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.188 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -142.82 156.34 44.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.473 0.654 . . . . 0.0 112.276 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.408 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.0 OUTLIER -136.47 124.42 34.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.468 179.127 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -87.75 119.55 28.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.717 0.294 . . . . 0.0 110.752 -178.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.414 ' O ' ' N ' ' A' ' 41' ' ' ILE . 4.1 mp -88.84 -14.86 35.94 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.457 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 6.4 p-10 -56.04 -46.54 78.83 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.457 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.1 p30 -92.36 -10.0 39.78 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 122.081 -0.387 . . . . 0.0 111.564 179.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -96.33 -64.6 1.03 Allowed 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.423 ' CD1' ' NE1' ' A' ' 50' ' ' TRP . 33.0 mm -80.52 147.54 6.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.541 178.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.437 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.18 171.55 13.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.772 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.451 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 22.7 t30 -113.18 112.53 23.94 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.033 -179.321 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.403 ' N ' ' CD1' ' A' ' 44' ' ' ILE . 1.9 mp -110.61 89.4 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.726 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 52.7 t0 67.55 39.39 2.84 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.402 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.74 0.75 87.63 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.674 -0.774 . . . . 0.0 113.263 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.1 m -112.63 135.28 53.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.15 0.475 . . . . 0.0 110.632 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.1 mt -77.34 118.9 20.27 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.553 0.692 . . . . 0.0 111.305 -178.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.9 mttt -136.82 162.75 32.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.851 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.449 ' CE2' HG12 ' A' ' 90' ' ' VAL . 9.2 m-90 -85.54 119.83 26.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.941 0.4 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -173.77 148.31 1.43 Allowed Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.28 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -67.22 65.53 0.67 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.317 2.011 . . . . 0.0 112.833 -179.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.437 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.2 p -157.63 134.35 9.91 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.823 178.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.434 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.0 109.28 15.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.125 0.488 . . . . 0.0 112.059 -178.034 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.413 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 32.7 p90 -48.45 -29.09 3.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.532 178.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.8 p -48.65 -19.34 0.34 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.687 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -62.36 -25.25 67.81 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 121.066 -0.254 . . . . 0.0 111.271 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.451 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -133.82 3.4 3.49 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.2 m -115.36 149.49 37.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.269 0.557 . . . . 0.0 112.34 -178.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -143.03 157.81 44.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.782 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 64.28 46.19 3.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.903 0.383 . . . . 0.0 110.512 -178.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 72.4 m -70.12 135.33 49.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.689 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.63 152.04 42.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.768 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.423 HG13 ' HB2' ' A' ' 13' ' ' LEU . 22.0 mt -129.71 140.18 49.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.305 0.574 . . . . 0.0 111.762 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -135.6 108.92 7.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.044 179.038 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.94 -120.99 13.18 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.081 -178.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.8 p -102.11 -3.93 26.73 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.5 t -101.83 139.95 21.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-O 120.902 0.382 . . . . 0.0 111.561 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.6 tp -104.08 128.88 51.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.854 -179.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.5 m -118.09 127.11 53.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.417 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -151.93 153.34 33.92 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.276 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.478 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.7 m -94.59 125.83 39.49 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 78.8 m -126.18 144.56 50.72 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.62 137.31 42.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.645 178.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.0 mtp85 -92.56 144.64 25.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.706 0.289 . . . . 0.0 110.591 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.3 m -51.87 -28.06 14.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.7 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -83.43 1.95 39.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.667 0.27 . . . . 0.0 111.554 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.29 136.97 7.17 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.655 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.39 -171.27 13.69 Favored Glycine 0 C--N 1.32 -0.352 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -130.06 141.12 50.75 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.296 0.548 . . . . 0.0 111.212 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -153.93 130.67 10.8 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.232 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.478 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.2 t -93.57 134.95 35.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.681 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 92.3 p -123.24 158.33 31.12 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.298 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.1 p -123.42 146.47 47.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.257 -179.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.44 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 14.1 tt -145.41 143.1 22.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.584 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -95.79 119.13 33.73 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.971 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 10.9 mt -99.26 -5.65 29.46 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.437 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 12.4 t-20 -44.75 -28.2 0.6 Allowed 'General case' 0 N--CA 1.467 0.404 0 O-C-N 122.081 -0.387 . . . . 0.0 111.982 -178.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.0 t -82.35 -40.06 21.91 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.461 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.2 m -72.4 -53.0 20.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -178.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.461 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -83.41 147.44 5.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.017 0.437 . . . . 0.0 111.339 -179.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 99' ' ' LYS . 11.9 tt0 -138.33 165.86 25.68 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.974 -178.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -108.45 100.13 9.44 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.156 0.503 . . . . 0.0 110.586 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.9 t -98.97 98.59 7.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.072 179.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.2 t0 53.06 33.74 15.62 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 111.752 0.278 . . . . 0.0 111.752 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.46 28.56 12.59 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.344 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.8 m -140.68 136.07 32.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.861 0.362 . . . . 0.0 111.296 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.408 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 59.3 mt -74.39 119.25 18.34 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.5 mmtt -125.17 138.23 54.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.374 -179.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.447 ' CE1' ' HB ' ' A' ' 90' ' ' VAL . 89.0 t80 -77.47 162.0 27.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.344 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.408 ' HG3' ' CE2' ' A' ' 100' ' ' TYR . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.886 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.716 -0.154 . . . . 0.0 112.716 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 13.7 tp -112.78 -43.5 3.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.685 0.278 . . . . 0.0 111.015 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -164.4 -121.17 0.55 Allowed Glycine 0 CA--C 1.52 0.377 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.959 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 49.3 mttt 64.9 68.55 0.51 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.874 0.369 . . . . 0.0 110.949 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.432 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 30.1 p90 -93.49 -39.95 10.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.648 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 7.5 tp -63.49 -17.29 19.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.912 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.76 -26.82 57.75 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.943 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.9 p -118.96 20.8 12.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.283 179.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 65.7 m -136.34 154.74 50.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.033 0.444 . . . . 0.0 111.407 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 ptm85 -133.78 173.16 11.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.192 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 48.85 57.82 5.99 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.072 -0.513 . . . . 0.0 112.106 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.1 p -79.06 131.96 36.44 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 178.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -157.56 164.02 37.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.892 0.377 . . . . 0.0 111.743 -178.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.429 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.9 OUTLIER -97.41 136.01 38.47 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.056 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.11 143.84 47.95 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.63 -151.78 32.21 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 119.797 -1.192 . . . . 0.0 111.608 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.0 -37.5 18.9 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -178.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -142.12 36.56 1.55 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -115.51 147.29 40.83 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.985 0.421 . . . . 0.0 111.704 178.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.403 ' HB2' HD13 ' A' ' 37' ' ' LEU . 17.0 tp -120.55 123.66 43.42 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.55 143.85 46.47 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.4 172.74 15.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.522 -178.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -112.34 133.55 54.38 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 177.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 84.5 m -130.8 133.97 46.44 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 8.5 ptpt -66.51 134.86 53.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.011 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 70.8 p -84.05 -176.2 6.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.504 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.25 -30.5 70.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.753 0.311 . . . . 0.0 111.036 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.64 10.04 8.28 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 66.89 37.77 3.9 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.151 0.5 . . . . 0.0 111.778 -179.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.418 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 66.6 mt-30 -120.32 135.19 55.1 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.015 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.418 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 30.4 m-85 -92.93 125.09 37.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.136 0.493 . . . . 0.0 111.708 -178.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 22.9 m -128.25 153.08 37.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.607 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.7 m -72.65 134.37 45.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.144 0.497 . . . . 0.0 111.807 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.5 t -144.38 161.55 38.72 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.349 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.1 ttmt -144.29 156.47 44.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.21 0.529 . . . . 0.0 111.895 -179.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.3 tp -134.91 129.76 51.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.027 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -88.98 115.48 26.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.63 0.252 . . . . 0.0 111.48 -178.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.0 mp -87.0 -14.99 40.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.511 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -46.18 79.2 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -178.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -92.23 -10.0 40.15 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -96.7 -64.93 1.0 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.446 HD13 ' CD1' ' A' ' 50' ' ' TRP . 21.1 mm -79.86 146.03 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.537 178.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -137.82 171.34 14.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.804 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.426 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 28.9 t30 -111.4 108.01 17.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.618 -179.336 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.5 mm -108.65 89.06 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.645 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 54.8 t0 66.13 39.0 4.47 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.305 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.14 0.47 89.58 Favored Glycine 0 CA--C 1.519 0.32 0 C-N-CA 120.872 -0.68 . . . . 0.0 113.32 179.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 52.6 m -110.16 136.36 49.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.077 0.439 . . . . 0.0 110.78 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.2 mt -77.23 117.52 18.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.639 0.733 . . . . 0.0 111.359 -178.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -137.57 162.54 33.5 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 114.706 -1.134 . . . . 0.0 110.354 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.446 ' CD1' HD13 ' A' ' 41' ' ' ILE . 9.9 m-90 -86.91 119.3 26.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.992 0.425 . . . . 0.0 111.072 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.423 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 32.4 tt0 -173.05 143.24 1.08 Allowed Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.658 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.423 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 32.0 Cg_endo -64.72 72.59 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.019 1.812 . . . . 0.0 112.544 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.2 p -162.85 136.01 5.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.87 -1.059 . . . . 0.0 108.882 179.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -83.01 109.88 17.48 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.407 ' HA ' ' CB ' ' A' ' 43' ' ' ASN . 29.4 p90 -49.95 -30.31 10.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.919 178.539 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.1 p -49.17 -18.58 0.35 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -63.22 -25.49 68.36 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.853 -0.339 . . . . 0.0 111.455 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.426 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.8 p -131.5 -0.64 3.96 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.545 179.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.3 m -109.72 148.62 31.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.113 0.482 . . . . 0.0 112.016 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -142.4 157.38 44.84 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.684 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 21.5 m120 63.38 45.08 5.07 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.61 -179.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 67.6 m -68.0 137.37 55.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.56 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.88 152.44 42.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.801 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.429 HG13 ' HB2' ' A' ' 13' ' ' LEU . 35.4 mt -130.93 139.29 51.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.291 0.567 . . . . 0.0 111.932 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -136.86 110.32 7.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.82 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.73 -121.54 12.53 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.466 -0.874 . . . . 0.0 111.202 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.8 p -101.61 -4.32 26.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.1 t -101.54 141.12 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.3 tp -102.71 123.53 46.57 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.439 179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.3 m -114.46 124.4 51.83 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.3 t -152.15 153.8 34.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.63 0.252 . . . . 0.0 111.399 -178.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 16.3 m -94.85 126.56 40.25 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 87.9 m -125.86 145.49 50.22 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -75.06 136.45 41.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.261 177.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 45.3 mtp180 -93.07 144.47 25.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.714 0.292 . . . . 0.0 110.944 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 46.8 m -52.21 -25.87 10.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.641 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -82.36 0.28 42.54 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.76 0.314 . . . . 0.0 111.174 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.45 135.38 7.03 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.89 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 113.83 -166.04 12.11 Favored Glycine 0 C--N 1.319 -0.378 0 N-CA-C 111.447 -0.661 . . . . 0.0 111.447 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -131.41 143.82 50.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 117.148 0.474 . . . . 0.0 111.295 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -154.25 130.79 10.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.267 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.0 t -94.31 134.88 36.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.664 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.6 p -123.27 158.41 31.01 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.662 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.7 p -122.64 146.63 47.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.849 0.357 . . . . 0.0 111.174 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.9 tt -145.81 143.2 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.803 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -97.1 117.29 30.97 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.853 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 11.1 mt -98.78 -4.62 32.94 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -178.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -44.77 -27.25 0.48 Allowed 'General case' 0 N--CA 1.469 0.515 0 O-C-N 122.0 -0.438 . . . . 0.0 112.101 -178.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.1 t -81.77 -41.94 20.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.444 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.0 m -70.72 -52.45 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -177.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.444 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -83.43 147.1 6.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 120.941 0.401 . . . . 0.0 111.58 -178.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.434 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 36.1 tt0 -137.71 164.29 29.23 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.886 -178.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -106.04 99.69 9.27 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-O 121.195 0.522 . . . . 0.0 110.697 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -98.05 97.56 6.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.29 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 30.8 t0 52.46 32.29 11.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.61 0.243 . . . . 0.0 111.617 179.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.38 28.42 10.61 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.823 -0.703 . . . . 0.0 113.429 179.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.8 t -142.07 136.24 29.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.833 0.349 . . . . 0.0 111.463 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.434 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 78.9 mt -74.35 120.51 20.02 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.718 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.407 ' O ' ' N ' ' A' ' 92' ' ' GLU . 17.3 mttt -126.35 145.76 50.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.949 -178.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -73.62 -31.62 63.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.103 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.097 -179.831 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.191 0 N-CA-C 112.534 -0.226 . . . . 0.0 112.534 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -168.07 35.25 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.903 0.382 . . . . 0.0 110.625 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -128.39 -79.61 0.26 Allowed Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.27 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.407 ' HA ' ' ND2' ' A' ' 88' ' ' ASN . 53.6 mttt 63.09 73.42 0.46 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.884 0.373 . . . . 0.0 111.242 179.599 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.47 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 25.5 p90 -92.1 -38.46 12.17 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.409 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.423 ' O ' HG13 ' A' ' 5' ' ' ILE . 5.1 tp -66.4 -14.6 17.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.713 0.292 . . . . 0.0 111.447 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -77.29 -27.52 53.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 0.0 110.683 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.9 p -118.68 19.11 13.3 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.258 179.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.6 m -133.1 154.48 50.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.04 0.448 . . . . 0.0 111.374 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.59 172.41 12.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.964 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 p30 49.4 57.68 6.23 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.4 p -79.85 133.17 36.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 177.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -158.56 163.89 36.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.592 -179.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.439 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.7 OUTLIER -97.56 136.47 37.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.268 0.556 . . . . 0.0 111.167 -179.745 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.22 143.26 48.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.282 179.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.14 -150.31 37.0 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 119.884 -1.15 . . . . 0.0 111.565 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -86.29 -37.12 18.87 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -178.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.442 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.19 35.33 1.52 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -114.67 149.65 36.4 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.986 0.422 . . . . 0.0 111.679 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 14.2 tp -122.87 123.89 42.0 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.35 143.12 47.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.877 0.37 . . . . 0.0 110.212 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.82 172.86 15.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.255 -178.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -109.36 135.08 51.0 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.6 m -130.61 131.86 45.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.154 0.502 . . . . 0.0 111.415 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 0.4 OUTLIER -66.03 137.06 56.83 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.459 -179.491 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 75.8 p -86.52 -178.15 6.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.481 179.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.3 mmt180 -60.38 -29.05 68.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.714 0.293 . . . . 0.0 111.247 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.85 9.18 10.44 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -178.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 66.77 37.29 4.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.119 0.485 . . . . 0.0 111.393 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.451 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 27.3 mm-40 -118.18 137.81 52.74 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 177.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -93.15 125.04 37.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.946 0.403 . . . . 0.0 111.548 -178.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.4 m -128.42 150.08 33.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.733 179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 20.5 t -70.92 133.65 46.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.076 0.465 . . . . 0.0 111.41 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.7 t -144.59 161.53 38.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.464 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -143.1 157.91 44.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.396 0.617 . . . . 0.0 112.049 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.419 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.1 tp -137.08 128.56 42.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.142 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -88.23 116.78 26.67 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.438 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.6 mp -86.27 -14.44 43.72 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.544 178.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.406 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -56.19 -48.91 75.44 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.251 0.464 . . . . 0.0 112.251 -178.461 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.83 -10.48 39.63 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 122.014 -0.429 . . . . 0.0 111.56 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.427 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 32.2 m-70 -96.07 -64.5 1.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 2.1 mp -80.26 148.51 5.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.276 178.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.412 ' HB1' ' HB2' ' A' ' 51' ' ' GLN . . . -141.15 171.63 13.8 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.784 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.45 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 25.0 t30 -113.19 112.29 23.53 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.324 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.425 ' CD1' ' HB2' ' A' ' 49' ' ' LYS . 2.5 mp -112.97 89.28 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.141 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t0 68.43 37.02 2.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.252 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.95 0.28 87.43 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.425 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.3 m -109.81 135.02 51.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 117.254 0.527 . . . . 0.0 110.729 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.7 mt -77.31 116.56 18.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.838 0.828 . . . . 0.0 111.335 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.425 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 61.0 mttt -139.42 163.57 32.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.109 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.447 ' CE2' HG12 ' A' ' 90' ' ' VAL . 9.5 m-90 -87.83 127.82 35.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.091 0.472 . . . . 0.0 112.246 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.412 ' HB2' ' HB1' ' A' ' 42' ' ' ALA . 1.5 mt-30 -172.57 152.21 2.54 Favored Pre-proline 0 N--CA 1.467 0.385 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.896 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.3 62.21 2.68 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 121.86 1.707 . . . . 0.0 112.029 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.51 135.34 10.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.633 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.403 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.77 110.99 16.8 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -177.852 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.442 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 39.5 p90 -48.32 -29.63 4.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.512 178.264 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.0 p -49.02 -17.82 0.24 Allowed 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -179.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -63.01 -28.67 70.26 Favored 'General case' 0 C--N 1.332 -0.166 0 O-C-N 122.163 -0.336 . . . . 0.0 111.141 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.45 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -128.56 -0.05 5.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.522 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.3 m -111.47 148.73 32.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.316 0.579 . . . . 0.0 112.395 -178.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -143.3 157.86 44.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.132 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 63.64 45.34 4.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.013 0.435 . . . . 0.0 110.887 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 74.9 m -70.33 137.26 50.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.828 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.77 151.65 41.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.4 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.49 HD13 HG23 ' A' ' 64' ' ' ILE . 57.5 mt -130.58 141.18 46.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.353 0.597 . . . . 0.0 112.094 -179.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -137.0 109.05 7.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.318 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.38 -119.93 12.35 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.446 -0.883 . . . . 0.0 111.689 -178.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 25.8 p -100.69 -4.71 27.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 t -103.18 140.59 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-O 121.041 0.448 . . . . 0.0 112.208 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.0 tp -103.37 126.93 50.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.516 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 31.8 m -115.71 125.54 52.95 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 t -151.57 153.43 34.51 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.297 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 6.2 m -95.02 126.0 40.06 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.6 m -126.44 145.18 50.58 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -74.77 137.3 41.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.954 178.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 49.2 mtm180 -91.93 144.49 25.41 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.348 179.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.4 m -51.98 -27.03 11.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.579 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -82.85 1.55 38.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.354 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.96 137.82 7.4 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.314 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.75 -168.16 12.49 Favored Glycine 0 C--N 1.319 -0.386 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -178.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -133.7 143.32 48.44 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 117.379 0.59 . . . . 0.0 111.431 -179.532 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -154.14 131.28 11.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.185 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -93.48 134.46 35.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.612 -179.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.6 p -121.73 158.09 29.52 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.189 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 78.7 p -122.74 144.34 49.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.383 . . . . 0.0 111.136 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.405 HD11 ' CZ2' ' A' ' 50' ' ' TRP . 13.8 tt -145.13 142.93 22.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.64 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -96.86 116.18 28.72 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.401 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 3.6 mt -96.71 -4.3 41.01 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -178.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.47 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 11.9 t-20 -44.45 -26.91 0.39 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.0 m -81.86 -40.98 21.65 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.447 HG12 ' CE2' ' A' ' 50' ' ' TRP . 3.8 m -72.98 -52.64 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 113.485 0.921 . . . . 0.0 113.485 -177.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.453 ' HB ' ' CD1' ' A' ' 4' ' ' PHE . 2.7 mp -81.83 147.57 6.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.042 0.448 . . . . 0.0 111.319 -179.201 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.408 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 20.0 tt0 -139.88 166.19 25.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.013 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -106.8 99.61 9.17 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-O 121.207 0.527 . . . . 0.0 110.349 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.8 t -98.46 98.0 6.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.616 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 31.7 t0 53.57 33.23 15.86 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.93 28.41 12.11 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.766 -0.731 . . . . 0.0 113.79 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.6 m -141.38 137.89 32.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.907 0.384 . . . . 0.0 111.108 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.419 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 67.8 mt -73.91 119.66 18.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.365 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 16.3 mttt -123.92 139.27 54.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.844 -178.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.427 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 20.3 t80 -85.65 -54.43 4.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.233 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.702 179.545 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 N-CA-C 112.546 -0.221 . . . . 0.0 112.546 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 11.5 tp -166.81 120.71 1.04 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.719 0.295 . . . . 0.0 110.864 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 62.54 -92.4 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.331 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? 61.94 70.91 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.868 0.366 . . . . 0.0 110.731 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.458 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 19.2 p90 -92.04 -37.52 12.75 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.359 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.403 ' O ' HG13 ' A' ' 5' ' ' ILE . 5.2 tp -68.12 -10.43 12.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 120.705 0.288 . . . . 0.0 111.469 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -77.28 -25.88 51.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.842 0.353 . . . . 0.0 110.798 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.3 p -118.31 -2.35 11.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.75 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.2 m -110.51 152.71 26.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.123 0.487 . . . . 0.0 111.143 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.406 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 1.2 ptm180 -132.87 172.84 12.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.606 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.408 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.4 p-10 50.13 56.97 7.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.951 0.405 . . . . 0.0 112.017 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.3 p -79.52 132.72 36.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.998 178.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -157.19 163.3 39.0 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.281 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.485 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.5 OUTLIER -97.56 136.1 38.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.789 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.41 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.58 145.65 47.14 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.027 179.176 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.67 -153.4 29.11 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 119.731 -1.224 . . . . 0.0 111.196 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.2 -36.85 19.21 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.22 35.94 1.9 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.41 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 15.3 mp0 -116.67 147.66 41.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.088 0.471 . . . . 0.0 111.737 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.405 ' HB2' HD12 ' A' ' 37' ' ' LEU . 13.6 tp -121.75 125.55 46.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.536 -0.756 . . . . 0.0 108.988 178.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.04 142.69 47.12 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.867 0.365 . . . . 0.0 110.104 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.11 172.17 17.25 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.118 -178.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -114.33 134.77 54.72 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 177.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 59.3 m -130.49 133.32 46.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.148 0.499 . . . . 0.0 111.693 -178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 1.3 pttt -66.47 136.06 55.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.335 -179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 46.0 p -84.51 -176.98 6.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.503 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.2 mmt180 -62.33 -29.79 70.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.145 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.74 9.78 7.29 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 66.77 37.29 4.24 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.144 0.497 . . . . 0.0 111.397 -178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 28.2 mt-30 -118.51 137.47 53.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.088 178.241 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -94.23 126.5 39.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.898 0.38 . . . . 0.0 111.625 -178.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 25.6 m -131.04 153.0 38.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.051 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.9 m -73.16 134.11 44.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.12 0.486 . . . . 0.0 111.547 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.0 t -144.59 161.48 39.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.062 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.6 ttpt -141.4 156.84 45.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.454 0.645 . . . . 0.0 112.234 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.1 tp -136.83 123.76 30.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 114.899 -1.046 . . . . 0.0 108.566 179.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -86.8 118.75 26.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.693 0.282 . . . . 0.0 110.673 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.428 ' O ' ' N ' ' A' ' 41' ' ' ILE . 4.3 mp -86.95 -14.98 40.22 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.491 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.1 p-10 -57.28 -43.73 83.36 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.288 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.1 p30 -91.8 -10.06 41.24 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 122.247 -0.283 . . . . 0.0 111.433 179.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.406 ' CE1' ' CB ' ' A' ' 100' ' ' TYR . 46.7 m-70 -99.84 -64.19 1.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.439 HD12 ' CD1' ' A' ' 50' ' ' TRP . 26.0 mm -78.64 146.97 7.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.53 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.441 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -139.56 172.01 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.611 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.496 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 26.7 t30 -112.74 108.25 17.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.824 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.2 mm -109.18 89.54 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.03 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.7 t70 68.3 39.54 2.27 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.138 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.3 0.71 90.04 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.903 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.8 m -110.61 137.2 48.6 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.845 0.355 . . . . 0.0 110.762 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 11.5 mt -77.21 116.78 18.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.609 0.718 . . . . 0.0 111.281 -178.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -135.49 162.09 33.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.805 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.45 ' CE2' HG13 ' A' ' 90' ' ' VAL . 6.1 m-90 -86.21 121.55 28.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.993 0.425 . . . . 0.0 111.476 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.424 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 40.5 tt0 -174.17 150.36 1.56 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.38 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.446 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 7.3 Cg_exo -70.42 65.64 2.18 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.237 1.958 . . . . 0.0 112.369 -179.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.441 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 24.6 p -157.45 134.72 10.36 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.394 178.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.436 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.36 108.12 14.71 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -177.557 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.413 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 40.9 p90 -47.67 -30.69 3.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.22 178.267 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.6 p -47.26 -18.4 0.1 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.853 -179.459 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -65.08 -27.06 68.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.614 0.245 . . . . 0.0 111.535 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.496 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.5 p -129.22 -1.4 5.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.451 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -111.69 149.62 31.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.184 0.516 . . . . 0.0 111.916 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -142.19 157.58 44.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.735 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.4 m120 64.13 48.7 2.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.981 0.419 . . . . 0.0 110.657 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 62.8 m -71.37 134.27 46.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.555 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.78 151.84 43.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.561 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.485 HG13 ' HB2' ' A' ' 13' ' ' LEU . 34.6 mt -130.4 141.52 46.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-O 121.353 0.597 . . . . 0.0 112.185 -179.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -137.74 109.0 6.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.887 178.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.17 -121.83 12.07 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.464 -0.874 . . . . 0.0 111.332 -178.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.2 p -102.47 -2.69 28.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.0 t -102.36 139.32 23.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.952 0.406 . . . . 0.0 111.592 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.3 tp -102.35 128.2 49.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.628 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.2 m -116.8 123.92 48.29 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.1 t -151.63 153.28 34.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.608 0.242 . . . . 0.0 111.21 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.6 m -94.83 126.15 39.96 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.406 ' HB3' ' OD1' ' A' ' 43' ' ' ASN . 81.4 m -125.59 144.32 50.63 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -74.52 136.98 42.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.587 178.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -92.53 142.32 27.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.717 0.294 . . . . 0.0 110.583 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.1 m -52.13 -26.26 10.86 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.619 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -83.18 1.36 40.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.659 0.266 . . . . 0.0 111.532 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.13 133.42 6.53 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.804 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.83 -169.02 12.8 Favored Glycine 0 C--N 1.317 -0.483 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 -178.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -132.26 144.03 50.32 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 117.238 0.519 . . . . 0.0 111.413 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -154.11 129.98 10.17 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.558 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.4 t -91.82 134.67 34.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.41 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 29.7 p -123.42 158.04 32.06 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.402 179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.0 m -122.45 145.53 48.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.02 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 13.9 tt -144.78 143.37 22.74 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.725 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -96.43 116.18 28.64 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.103 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.415 ' O ' HG22 ' A' ' 90' ' ' VAL . 11.6 mt -96.95 -6.99 34.28 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -179.117 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.458 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 13.2 t-20 -44.86 -28.19 0.62 Allowed 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -178.359 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.4 m -81.98 -38.23 25.46 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.469 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 2.9 m -74.4 -53.46 17.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -178.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.469 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.2 147.63 5.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.06 0.457 . . . . 0.0 111.268 -178.942 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.427 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 9.9 tt0 -137.32 166.54 23.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.157 -178.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -107.21 99.42 8.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.121 0.486 . . . . 0.0 110.184 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.417 HG23 ' CD ' ' A' ' 99' ' ' LYS . 33.1 t -98.28 96.08 4.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.196 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.3 t0 53.09 33.47 15.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.655 0.264 . . . . 0.0 111.466 179.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.59 28.65 12.17 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.269 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 62.5 p -140.92 133.76 29.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.802 0.334 . . . . 0.0 110.912 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.427 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 77.4 mt -74.49 121.07 20.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.732 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.455 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 8.5 mttm -125.11 137.0 54.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.076 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.406 ' CB ' ' CE1' ' A' ' 40' ' ' HIS . 39.1 t80 -82.78 153.91 25.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.649 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.789 179.845 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.166 0 N-CA-C 112.444 -0.262 . . . . 0.0 112.444 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 19.0 mt -83.67 174.1 10.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.812 0.339 . . . . 0.0 110.865 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.81 147.44 48.38 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.6 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.4 ptpt -148.95 87.96 1.58 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.829 0.347 . . . . 0.0 110.727 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.438 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 14.1 p90 -92.97 -40.5 10.53 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.662 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.0 tp -63.87 -19.33 24.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.633 0.254 . . . . 0.0 111.446 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -75.45 -26.79 58.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.819 0.342 . . . . 0.0 110.855 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.7 p -118.66 13.95 13.43 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.537 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 71.1 m -127.11 153.6 45.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.037 0.446 . . . . 0.0 111.477 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -133.1 172.58 12.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.96 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.0 p30 49.62 57.66 6.27 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 31.3 p -79.65 134.15 36.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.015 178.095 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -158.86 163.84 36.26 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.132 -179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.456 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.39 136.22 38.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.177 0.513 . . . . 0.0 110.991 -179.779 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.74 145.01 46.93 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.381 179.097 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.62 -152.38 30.95 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.55 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -85.89 -37.14 19.45 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -142.11 35.54 1.54 Allowed 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.8 mp0 -114.34 146.91 39.93 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.927 0.394 . . . . 0.0 111.48 178.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 14.0 tp -120.3 124.49 45.72 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.74 144.55 48.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.94 0.4 . . . . 0.0 110.048 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.79 172.8 15.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.089 -178.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -109.78 133.98 52.53 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 83.0 m -130.67 134.11 46.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.191 0.52 . . . . 0.0 112.139 -178.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.6 ptpt -66.43 137.3 56.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.506 -179.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.8 p -86.06 -179.52 6.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.447 179.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -60.36 -29.87 69.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.655 0.264 . . . . 0.0 111.134 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.66 10.39 9.38 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 66.88 39.74 3.29 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.207 0.527 . . . . 0.0 112.052 -179.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.419 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 68.1 mt-30 -119.96 136.03 54.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.403 -0.817 . . . . 0.0 108.853 177.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -92.09 126.39 37.15 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.023 0.439 . . . . 0.0 111.958 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 29.3 m -131.09 152.49 37.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.163 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.3 t -72.96 134.39 44.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.135 0.493 . . . . 0.0 111.667 -179.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 t -145.76 161.57 39.62 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.362 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 20.2 ttpt -144.04 157.17 44.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.353 0.597 . . . . 0.0 112.139 -179.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -135.21 129.4 50.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.834 179.498 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -88.52 116.44 26.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.558 0.218 . . . . 0.0 111.414 -178.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.2 mp -87.58 -15.91 36.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.325 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -47.28 73.44 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -178.439 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.423 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 3.2 m-20 -92.26 -10.33 38.9 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 122.169 -0.332 . . . . 0.0 111.755 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.7 m-70 -96.29 -64.9 1.01 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.428 ' N ' ' CD1' ' A' ' 41' ' ' ILE . 1.9 mp -82.53 147.71 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.419 178.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -141.3 171.99 13.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.815 -0.629 . . . . 0.0 112.081 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.431 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 22.6 t30 -112.87 113.21 25.18 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.941 -179.291 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.418 ' CD1' ' HB2' ' A' ' 49' ' ' LYS . 2.5 mp -113.59 89.49 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.937 0.399 . . . . 0.0 111.141 179.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 50.1 t0 69.77 37.26 1.88 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.449 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.03 0.75 87.11 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.643 -0.789 . . . . 0.0 113.293 179.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 39.8 m -112.84 135.97 53.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 117.198 0.499 . . . . 0.0 110.8 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.8 mt -77.18 117.19 18.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.635 0.731 . . . . 0.0 111.733 -177.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.418 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 30.0 mmtt -137.82 162.86 32.84 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.641 179.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.471 ' CE2' HG11 ' A' ' 90' ' ' VAL . 3.6 m-90 -86.51 125.06 33.49 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.031 0.443 . . . . 0.0 111.99 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -175.85 149.09 1.01 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.917 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.423 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 7.7 Cg_exo -69.04 66.75 1.34 Allowed 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.981 1.788 . . . . 0.0 112.061 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -156.81 131.38 8.74 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.184 179.096 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.68 109.36 15.15 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.258 0.552 . . . . 0.0 112.245 -177.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.424 ' CZ ' ' CB ' ' A' ' 17' ' ' SER . 41.1 p90 -48.15 -31.23 5.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.723 178.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.5 p -49.69 -18.28 0.44 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.676 -179.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -62.06 -30.18 70.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.597 0.237 . . . . 0.0 111.013 -179.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.431 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -126.74 -3.39 6.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.289 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.2 m -108.14 148.99 29.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.216 0.532 . . . . 0.0 112.118 -178.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.8 p90 -142.96 157.67 44.34 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.053 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 63.36 44.11 5.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.007 0.432 . . . . 0.0 110.728 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 73.3 m -68.58 136.63 53.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.618 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.47 152.1 42.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.508 -179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.456 HG13 ' HB2' ' A' ' 13' ' ' LEU . 39.4 mt -129.01 139.68 51.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.238 0.542 . . . . 0.0 111.866 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -134.12 107.86 7.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.44 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.99 -120.19 13.4 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.4 -0.905 . . . . 0.0 111.3 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.3 p -99.88 -4.04 31.17 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.6 t -103.15 140.09 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.5 tp -103.16 125.57 49.92 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.573 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.1 m -115.3 125.74 53.64 Favored 'General case' 0 N--CA 1.461 0.108 0 N-CA-C 110.094 -0.335 . . . . 0.0 110.094 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.3 t -151.86 153.59 34.5 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.69 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 10.7 m -95.53 126.12 40.59 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.453 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 70.8 m -127.45 146.7 50.4 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -178.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -75.27 137.1 40.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.108 178.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 30.5 mtm180 -91.98 143.98 25.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.19 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 14.2 m -51.83 -27.17 11.64 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -179.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -82.39 1.81 35.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.694 0.283 . . . . 0.0 111.436 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.92 136.04 7.54 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.817 179.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.18 -166.85 12.23 Favored Glycine 0 C--N 1.319 -0.362 0 N-CA-C 111.658 -0.577 . . . . 0.0 111.658 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -133.32 143.09 48.79 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.979 0.419 . . . . 0.0 111.163 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -154.3 132.95 12.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.119 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.3 t -94.22 134.38 36.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.842 0.353 . . . . 0.0 111.656 -179.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.5 p -119.8 157.76 27.96 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.192 179.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.7 m -121.44 142.38 50.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.916 0.389 . . . . 0.0 111.088 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.432 HD12 ' CH2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -147.78 144.51 19.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.613 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -101.05 121.33 41.61 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.285 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.427 ' O ' HG21 ' A' ' 90' ' ' VAL . 2.3 mt -100.66 -3.22 30.77 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -179.405 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.438 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 5.3 t-20 -45.3 -26.92 0.58 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.706 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.91 -42.12 24.77 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.471 HG11 ' CE2' ' A' ' 50' ' ' TRP . 4.1 m -72.63 -51.32 28.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -177.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.441 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -81.78 147.3 6.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.037 0.446 . . . . 0.0 111.347 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 99' ' ' LYS . 3.9 tt0 -138.62 166.8 23.42 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.972 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -107.69 99.93 9.37 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.191 0.52 . . . . 0.0 110.855 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.3 t -98.89 97.14 5.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.13 179.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.8 t0 53.79 33.13 16.24 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.7 28.4 12.53 Favored Glycine 0 CA--C 1.518 0.271 0 C-N-CA 120.585 -0.817 . . . . 0.0 113.206 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.9 m -141.41 135.48 30.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.867 0.365 . . . . 0.0 111.318 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 28.1 mt -74.39 119.4 18.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.44 -179.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.404 ' O ' ' N ' ' A' ' 92' ' ' GLU . 0.3 OUTLIER -125.31 135.64 52.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.321 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.417 ' CD1' ' N ' ' A' ' 101' ' ' GLU . 8.5 t80 -82.27 146.26 29.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.678 178.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . 0.417 ' N ' ' CD1' ' A' ' 100' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.083 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 N-CA-C 112.786 -0.125 . . . . 0.0 112.786 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.2 pp -175.37 172.56 2.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.586 0.231 . . . . 0.0 110.746 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 89.33 -110.1 3.67 Favored Glycine 0 CA--C 1.521 0.417 0 C-N-CA 120.563 -0.827 . . . . 0.0 112.214 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.8 mmtp 62.16 64.84 0.93 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.767 0.318 . . . . 0.0 111.051 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -92.0 -41.72 10.39 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.733 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.406 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 4.4 tp -62.48 -21.11 26.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.389 -179.797 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -72.15 -24.28 61.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.744 0.307 . . . . 0.0 110.598 179.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.6 p -119.09 -3.99 10.6 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 86.3 m -107.19 152.07 24.56 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.811 0.339 . . . . 0.0 111.188 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -131.65 173.25 11.32 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.719 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 47.1 57.73 5.46 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 82.1 p -78.82 132.46 36.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.872 178.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -158.57 164.34 36.17 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.959 0.409 . . . . 0.0 111.667 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.474 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.9 OUTLIER -97.5 135.8 38.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.497 -179.315 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.13 145.1 46.25 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.257 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 56.64 -150.27 27.16 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.318 -0.944 . . . . 0.0 111.425 -178.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.35 -37.82 18.08 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.789 0.662 . . . . 0.0 112.789 -178.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.43 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.9 p -141.17 37.1 1.73 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -114.66 148.75 37.74 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.943 0.401 . . . . 0.0 111.869 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.406 ' N ' ' CD1' ' A' ' 37' ' ' LEU . 17.1 tp -121.89 122.35 39.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.191 179.198 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.73 143.43 46.22 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.38 172.68 16.13 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -113.63 133.36 55.34 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 54.7 m -130.47 132.78 45.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.148 0.499 . . . . 0.0 111.519 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -64.84 137.95 58.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.671 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 52.6 p -86.6 -177.42 6.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.771 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.8 mtp85 -61.48 -29.36 69.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.028 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.43 8.84 12.59 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 67.04 36.83 4.02 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.163 0.506 . . . . 0.0 111.274 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -117.07 134.53 54.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -90.99 124.92 35.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.119 0.485 . . . . 0.0 111.817 -178.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.6 m -130.16 150.86 35.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.635 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.7 t -72.03 136.57 46.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.345 0.593 . . . . 0.0 111.776 -178.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.7 t -145.34 162.35 37.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.212 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.404 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.9 OUTLIER -144.7 156.1 43.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.537 0.685 . . . . 0.0 111.92 -179.172 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.404 ' N ' ' HG2' ' A' ' 34' ' ' LYS . 1.0 OUTLIER -135.38 126.8 45.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.633 179.173 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -87.58 114.65 24.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.703 0.287 . . . . 0.0 110.807 -178.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.406 ' CD1' ' N ' ' A' ' 19' ' ' LEU . 3.6 mp -86.15 -15.51 40.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.952 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -46.04 78.29 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.631 -0.428 . . . . 0.0 111.591 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.55 -10.2 41.49 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.45 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 30.3 m-70 -96.61 -60.34 1.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.428 HD13 ' CD1' ' A' ' 50' ' ' TRP . 32.8 mm -81.03 146.75 6.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.571 178.767 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.424 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -139.56 170.14 16.45 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.395 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.43 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 34.7 t30 -111.92 108.69 18.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.86 -179.249 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 48.2 mm -108.51 88.76 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.791 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 53.8 t0 66.43 39.42 3.94 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.827 0.346 . . . . 0.0 111.563 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.78 0.38 89.79 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 121.007 -0.616 . . . . 0.0 113.404 179.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.0 m -109.02 136.33 48.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 117.009 0.405 . . . . 0.0 110.958 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 12.6 mt -77.57 117.03 18.61 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.519 0.676 . . . . 0.0 111.408 -178.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.7 mmtt -138.39 163.51 31.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.607 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.448 ' CZ2' HG11 ' A' ' 90' ' ' VAL . 7.4 m-90 -84.77 124.27 31.37 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.976 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.05 146.78 1.43 Allowed Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.848 -178.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -70.56 65.62 2.26 Favored 'Trans proline' 0 C--N 1.358 1.044 0 C-N-CA 122.464 2.11 . . . . 0.0 111.571 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.424 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.1 p -159.62 132.11 6.61 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.467 -1.242 . . . . 0.0 107.998 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.57 109.69 15.34 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -177.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.0 p90 -48.64 -30.31 5.3 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.974 177.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 35.4 p -49.92 -18.76 0.56 Allowed 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -63.1 -26.43 68.83 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.818 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.43 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 3.9 p -129.76 0.72 4.88 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.302 178.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.5 m -111.84 148.16 34.21 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.321 0.582 . . . . 0.0 112.268 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 35.5 p90 -141.7 157.99 44.37 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.528 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 64.3 42.56 5.25 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.838 0.351 . . . . 0.0 110.959 -179.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 55.0 m -68.57 137.88 54.66 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.498 179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.84 150.99 39.32 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.878 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.474 HG13 ' HB2' ' A' ' 13' ' ' LEU . 21.4 mt -129.09 140.24 49.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.47 0.652 . . . . 0.0 112.34 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -137.84 108.85 6.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.036 179.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.59 -122.64 12.44 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.322 -0.942 . . . . 0.0 111.145 -178.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.6 p -100.91 -5.46 26.0 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.2 t -101.1 140.77 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 120.995 0.426 . . . . 0.0 111.845 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.0 tp -104.28 127.61 51.94 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.655 179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.0 m -116.28 123.81 48.61 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.865 -179.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.3 t -151.47 153.28 34.33 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.242 -0.183 . . . . 0.0 111.304 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.449 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.5 m -95.45 126.11 40.52 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 72.7 m -125.8 145.16 50.34 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -75.78 136.84 40.26 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.598 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 45.3 mtm180 -91.78 146.19 23.96 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.634 0.254 . . . . 0.0 110.693 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.4 m -52.25 -30.39 27.47 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -82.26 1.52 36.33 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.481 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.43 137.04 6.75 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.481 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 118.45 -176.43 16.11 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -127.73 141.58 51.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.576 0.688 . . . . 0.0 110.903 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -153.84 128.8 9.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.015 0.436 . . . . 0.0 110.665 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.449 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -92.18 135.48 33.96 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.894 -179.325 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.3 p -122.46 158.22 30.24 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.102 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 58.2 m -124.95 146.26 49.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.882 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.417 HD13 ' CZ3' ' A' ' 50' ' ' TRP . 12.2 tt -146.34 143.69 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.769 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -95.41 119.72 34.39 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.386 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 7.1 mt -100.23 -5.81 27.0 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.406 ' ND2' ' CG2' ' A' ' 5' ' ' ILE . 11.1 t-20 -44.5 -29.1 0.66 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.13 -38.37 27.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.448 HG11 ' CZ2' ' A' ' 50' ' ' TRP . 3.1 m -74.42 -52.43 19.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -178.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.422 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -82.81 146.37 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-O 120.859 0.362 . . . . 0.0 111.866 -178.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -135.75 164.04 28.8 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.223 -178.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -107.05 99.75 9.28 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.38 0.61 . . . . 0.0 111.019 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 52.4 t -97.02 97.07 5.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.867 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.1 t0 51.65 33.3 10.57 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.03 28.75 9.63 Favored Glycine 0 C--N 1.329 0.168 0 C-N-CA 120.444 -0.884 . . . . 0.0 113.104 178.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 69.8 m -142.07 135.21 28.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.89 0.376 . . . . 0.0 111.035 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 44.5 mt -75.11 121.89 22.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.192 -179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.1 mttm -126.59 134.35 50.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.118 0.485 . . . . 0.0 112.178 -179.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.45 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 10.1 t80 -87.16 114.58 23.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.43 179.333 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.944 -179.694 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.066 0 N-CA-C 112.596 -0.202 . . . . 0.0 112.596 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 8.2 mt -98.31 -74.97 0.56 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.691 0.281 . . . . 0.0 110.8 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.06 160.95 53.26 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.78 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.6 mttt -155.31 83.4 1.06 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.52 0.2 . . . . 0.0 110.908 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.419 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 16.0 p90 -93.5 -41.07 9.98 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.402 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 8.2 tp -61.41 -20.73 23.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -74.12 -25.28 59.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.311 179.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.5 p -118.75 -5.95 10.63 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.667 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 66.3 m -104.91 152.77 22.24 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.08 0.467 . . . . 0.0 111.122 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -132.18 172.86 11.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.963 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 47.33 58.33 4.98 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.015 0.436 . . . . 0.0 111.721 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 54.4 p -79.11 130.27 35.33 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.664 178.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -156.67 164.13 38.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.778 -178.612 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.412 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.7 OUTLIER -97.45 136.89 37.23 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.918 -179.902 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.82 144.23 48.45 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 60.27 -152.63 36.95 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 119.818 -1.182 . . . . 0.0 111.589 -179.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.7 m -86.64 -36.32 18.85 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.406 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.9 p -142.65 34.67 1.43 Allowed 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -178.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -113.51 151.22 31.82 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.957 0.408 . . . . 0.0 112.081 178.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.425 ' N ' ' CD1' ' A' ' 37' ' ' LEU . 11.4 tp -124.85 124.88 43.02 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.185 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.55 143.34 48.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.69 172.74 15.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.176 -178.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -114.43 133.94 55.36 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 32.3 m -130.74 132.98 45.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.114 0.483 . . . . 0.0 111.877 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -65.74 137.83 57.53 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.435 -179.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 54.7 p -85.16 -176.31 6.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.575 179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -62.34 -30.12 70.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.915 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.51 9.02 10.1 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 66.95 37.9 3.77 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.035 0.445 . . . . 0.0 111.806 -178.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -118.77 135.66 54.39 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 177.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -90.6 124.98 35.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.921 0.391 . . . . 0.0 111.995 -178.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.9 m -129.79 148.54 33.21 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.755 179.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.3 m -70.25 135.1 48.67 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.22 0.533 . . . . 0.0 111.959 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -144.62 161.81 38.22 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.344 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.7 ttpt -142.92 157.43 44.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.531 0.682 . . . . 0.0 112.333 -179.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.413 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 0.9 OUTLIER -137.12 126.84 37.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.039 179.826 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -88.47 115.0 25.67 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.886 0.374 . . . . 0.0 111.535 -178.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.425 ' CD1' ' N ' ' A' ' 19' ' ' LEU . 2.8 mp -85.66 -16.42 39.18 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.543 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.403 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -55.84 -48.15 75.99 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.637 0.256 . . . . 0.0 111.214 -179.047 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.408 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.2 OUTLIER -91.47 -10.43 40.89 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.736 -0.386 . . . . 0.0 111.594 179.515 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -95.05 -66.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.408 HD13 HD22 ' A' ' 37' ' ' LEU . 45.3 mt -79.85 151.19 4.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.747 178.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -141.35 172.28 12.91 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.029 -179.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.417 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 37.1 t30 -109.2 109.68 20.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.809 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 44.7 mm -110.7 88.93 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.637 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.7 t70 68.15 39.84 2.31 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.604 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.15 1.14 90.52 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 120.625 -0.798 . . . . 0.0 113.094 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.3 m -112.54 137.05 51.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.88 0.371 . . . . 0.0 110.953 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 52.1 mt -76.66 116.07 17.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.548 0.69 . . . . 0.0 110.58 -178.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -135.18 161.96 33.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.609 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.471 ' CZ2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -87.78 120.89 29.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.991 0.424 . . . . 0.0 111.512 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.409 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 20.2 tt0 -175.25 143.73 0.76 Allowed Pre-proline 0 N--CA 1.465 0.28 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.823 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.409 ' HD2' ' HG3' ' A' ' 51' ' ' GLN . 33.6 Cg_endo -64.25 75.71 0.18 Allowed 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 121.983 1.789 . . . . 0.0 112.91 -179.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -165.68 133.5 2.98 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.332 179.126 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.07 110.0 16.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.231 0.539 . . . . 0.0 112.151 -178.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.406 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.2 p90 -49.58 -29.16 6.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.573 178.451 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 61.5 p -49.6 -17.7 0.35 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -62.51 -28.14 69.64 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.595 0.235 . . . . 0.0 111.216 -179.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.417 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.4 p -129.84 -1.25 4.76 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.9 m -109.49 147.62 32.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.332 0.587 . . . . 0.0 112.482 -178.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -142.92 158.52 43.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.605 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 64.31 43.53 4.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.858 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 74.3 m -68.64 137.06 53.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.931 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -144.0 152.93 41.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.291 179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.412 HG13 ' HB2' ' A' ' 13' ' ' LEU . 43.5 mt -130.47 140.87 47.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.254 0.549 . . . . 0.0 111.717 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -137.17 107.96 6.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.668 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.71 -122.29 11.84 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.615 -0.802 . . . . 0.0 111.631 -178.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.5 p -101.08 -5.33 25.87 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.6 t -101.41 139.56 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 120.882 0.372 . . . . 0.0 111.672 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.8 tp -101.67 127.73 48.29 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.675 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 7.2 m -116.75 123.12 46.39 Favored 'General case' 0 N--CA 1.461 0.099 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.1 t -151.96 153.99 35.17 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.748 -178.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.45 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.5 m -94.34 125.66 39.12 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 178.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 88.4 m -125.61 142.87 51.28 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.228 0.537 . . . . 0.0 112.445 -178.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -74.46 138.5 43.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.728 178.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.5 mtp180 -91.43 144.56 25.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.629 0.252 . . . . 0.0 110.629 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 24.6 m -52.62 -27.65 17.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.326 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -82.16 2.45 31.45 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.678 0.275 . . . . 0.0 111.208 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.78 136.46 6.7 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.726 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.59 -170.24 13.22 Favored Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 111.245 -0.742 . . . . 0.0 111.245 -178.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -130.73 142.36 50.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 117.23 0.515 . . . . 0.0 111.226 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -154.0 130.15 10.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.459 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.45 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.4 t -93.39 134.9 35.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.037 0.446 . . . . 0.0 111.743 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 89.7 p -122.22 158.49 29.33 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.344 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.4 m -122.76 146.05 47.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.823 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 9.7 tt -147.76 143.46 19.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.037 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -97.07 119.82 36.27 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.684 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.408 ' O ' HG21 ' A' ' 90' ' ' VAL . 9.4 mt -100.71 -6.41 25.08 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -178.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.419 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 6.2 t-20 -45.09 -29.72 0.95 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -178.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.3 t -81.28 -39.45 25.21 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.471 HG11 ' CZ2' ' A' ' 50' ' ' TRP . 2.8 m -72.68 -52.1 24.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.426 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.85 147.33 6.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 0.0 110.764 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -138.49 165.94 25.55 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.097 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 29.0 t30 -106.59 99.7 9.26 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.221 0.534 . . . . 0.0 110.27 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -98.54 95.32 4.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.885 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 33.9 t0 52.13 32.61 10.76 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.573 0.225 . . . . 0.0 111.58 179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.78 28.56 10.05 Favored Glycine 0 C--N 1.329 0.155 0 C-N-CA 120.593 -0.813 . . . . 0.0 113.635 178.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.1 m -141.65 134.33 28.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.932 0.366 . . . . 0.0 110.632 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.413 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 82.6 mt -73.26 120.6 19.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.678 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.4 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 11.7 mttt -125.91 141.07 52.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.136 0.493 . . . . 0.0 112.276 -178.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -80.85 76.04 7.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.31 179.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.173 -0.918 . . . . 0.0 111.06 -179.566 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.187 0 N-CA-C 112.45 -0.26 . . . . 0.0 112.45 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -64.39 -178.31 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.748 0.309 . . . . 0.0 110.804 -179.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -137.65 -58.06 0.05 OUTLIER Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.428 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.9 mttt 60.25 71.15 0.58 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.865 0.364 . . . . 0.0 110.844 -179.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.427 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 18.5 p90 -92.89 -39.33 11.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.789 -179.644 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.0 tp -63.4 -18.16 21.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.728 0.299 . . . . 0.0 111.495 -179.655 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -74.8 -24.31 58.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.978 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.1 p -118.71 15.1 13.57 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.649 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 56.5 m -131.47 154.09 49.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.171 0.51 . . . . 0.0 111.304 -179.655 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.4 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 6.3 ptt180 -132.76 173.19 11.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.676 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.419 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.7 p-10 48.95 56.71 7.34 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.0 p -79.37 133.75 36.59 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.565 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -158.09 164.21 36.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.845 -178.911 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -97.41 136.35 37.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.994 -179.859 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.5 144.62 46.91 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.454 -0.794 . . . . 0.0 108.993 178.977 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.15 -152.16 29.45 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.847 -1.168 . . . . 0.0 111.846 -179.09 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.73 -36.7 20.01 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.343 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -142.53 35.92 1.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.8 mp0 -114.5 147.53 39.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.199 0.523 . . . . 0.0 111.689 179.09 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.417 ' HB2' HD11 ' A' ' 37' ' ' LEU . 17.3 tp -120.93 123.99 43.84 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.394 179.287 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.42 142.98 49.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.961 0.41 . . . . 0.0 110.105 179.712 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.59 172.64 16.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.945 -178.788 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -111.82 133.73 53.84 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 176.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.3 m -130.61 133.95 46.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.072 0.463 . . . . 0.0 111.66 -178.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 8.1 ptpt -67.11 137.49 56.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.704 -179.479 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 72.1 p -85.59 -179.19 6.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.402 179.772 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -60.63 -29.77 69.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.659 0.266 . . . . 0.0 111.12 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.58 9.36 9.56 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -178.948 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 67.04 38.52 3.46 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.146 0.498 . . . . 0.0 111.911 -179.014 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -119.53 134.95 54.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.515 -0.766 . . . . 0.0 108.968 178.06 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -92.25 124.94 36.69 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.025 0.44 . . . . 0.0 111.821 -178.62 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.2 m -129.87 150.46 34.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.735 179.667 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.8 p -71.25 134.4 46.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.239 0.542 . . . . 0.0 111.725 -178.737 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.3 t -142.74 161.86 36.97 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.295 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.6 ttmt -143.67 156.18 44.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.481 0.658 . . . . 0.0 112.187 -179.07 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.1 tp -136.53 124.94 35.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 114.998 -1.001 . . . . 0.0 108.501 179.142 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -88.24 119.02 28.24 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.709 0.29 . . . . 0.0 111.294 -177.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.417 HD11 ' HB2' ' A' ' 19' ' ' LEU . 4.0 mp -89.04 -14.72 35.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.808 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.0 p-10 -57.87 -43.44 85.99 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.754 -178.467 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.423 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.5 OUTLIER -92.77 -10.52 36.64 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.944 -0.472 . . . . 0.0 111.611 178.691 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.463 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 26.6 m-70 -97.98 -64.2 1.06 Allowed 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 31.5 mm -80.07 145.73 8.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.444 178.764 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.431 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -137.92 171.46 14.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.5 -179.811 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.418 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 20.2 t30 -113.12 111.71 22.58 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.251 -178.968 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.405 ' N ' ' CD1' ' A' ' 44' ' ' ILE . 2.2 mp -112.7 95.03 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.394 179.192 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.3 t0 64.12 38.06 8.6 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.078 -179.561 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.08 11.63 82.17 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.218 179.374 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.7 m -120.4 136.49 54.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.024 0.412 . . . . 0.0 110.721 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 25.6 mt -77.42 118.1 19.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.559 0.695 . . . . 0.0 111.624 -177.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.6 mttt -139.15 163.42 32.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.006 -179.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.433 ' CE2' HG12 ' A' ' 90' ' ' VAL . 4.8 m-90 -85.4 119.0 25.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.956 0.408 . . . . 0.0 111.78 -179.413 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.431 ' CG ' ' O ' ' A' ' 50' ' ' TRP . 18.0 mt-30 -169.4 151.45 4.51 Favored Pre-proline 0 N--CA 1.468 0.425 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.5 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.75 60.82 2.91 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 121.975 1.783 . . . . 0.0 112.394 -179.744 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.431 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.7 p -153.43 135.75 14.96 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.442 -0.799 . . . . 0.0 108.89 179.123 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -81.03 113.06 18.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -177.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 48.5 p90 -52.57 -33.49 46.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.414 178.316 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 60.1 p -48.97 -21.29 0.64 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.702 -179.11 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -62.0 -25.26 67.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.62 0.248 . . . . 0.0 110.898 -179.278 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.418 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -127.71 -2.24 6.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.127 178.797 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.8 m -111.09 148.36 32.83 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.25 0.548 . . . . 0.0 112.369 -178.277 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 41.3 p90 -140.12 157.33 45.8 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.053 179.538 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 41.1 m-20 62.99 45.15 5.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.059 0.457 . . . . 0.0 110.444 -178.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 67.3 m -70.04 136.54 50.44 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.658 179.854 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.57 154.0 43.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.134 -179.618 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 47.0 mt -130.8 140.12 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.59 179.526 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -134.76 108.68 8.1 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.159 -0.928 . . . . 0.0 108.549 178.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.9 -119.68 11.26 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.327 -0.939 . . . . 0.0 111.193 -178.203 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 26.7 p -102.83 -3.49 26.24 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.411 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.3 t -101.55 137.58 28.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.93 0.395 . . . . 0.0 111.844 -179.835 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.3 tp -101.03 124.79 47.29 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.781 179.536 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.6 m -114.87 126.77 55.19 Favored 'General case' 0 CA--C 1.521 -0.144 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.349 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 t -151.68 153.62 34.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.73 0.3 . . . . 0.0 111.282 -179.127 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.6 m -94.3 125.61 39.04 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.703 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 85.9 m -128.55 147.2 50.69 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.44 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -75.48 136.79 40.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.179 178.505 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -91.7 144.05 25.92 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 179.282 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.3 m -52.19 -28.58 18.79 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.053 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -80.8 2.2 27.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.676 0.274 . . . . 0.0 111.504 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.03 135.06 6.7 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.561 179.99 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.5 -168.72 12.99 Favored Glycine 0 C--N 1.318 -0.442 0 N-CA-C 111.612 -0.595 . . . . 0.0 111.612 -179.0 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -131.2 141.14 50.01 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.877 0.339 . . . . 0.0 110.992 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -154.6 132.66 11.68 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.653 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.483 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -94.44 134.55 36.84 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.784 -179.367 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.5 p -121.46 157.99 29.38 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.897 0.38 . . . . 0.0 110.63 179.696 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 8.1 p -120.76 143.92 48.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.328 -179.511 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.405 HD12 ' CZ2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -146.83 145.5 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.333 179.563 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 21.0 t0 -101.5 121.54 42.15 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.422 -179.479 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.412 ' O ' HG22 ' A' ' 90' ' ' VAL . 4.3 mt -103.46 -2.88 26.16 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -178.897 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.4 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 13.0 t-20 -44.87 -27.31 0.51 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.388 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.4 m -81.37 -39.13 25.49 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.64 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.433 HG12 ' CE2' ' A' ' 50' ' ' TRP . 3.7 m -75.3 -52.45 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -177.668 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.427 ' HB ' ' CD1' ' A' ' 4' ' ' PHE . 2.6 mp -80.52 145.57 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.895 0.378 . . . . 0.0 110.969 -179.148 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -136.84 165.97 24.71 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.343 -178.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -105.9 99.28 8.88 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.116 0.484 . . . . 0.0 110.34 179.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.2 t -98.59 95.49 4.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.108 179.564 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.7 t0 55.35 31.88 17.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.626 0.251 . . . . 0.0 111.559 179.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.07 28.21 12.29 Favored Glycine 0 C--N 1.329 0.158 0 C-N-CA 120.745 -0.74 . . . . 0.0 113.156 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 74.0 m -140.3 135.09 31.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.757 0.313 . . . . 0.0 110.801 179.776 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 66.6 mt -73.48 121.19 20.16 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.085 -179.652 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 17.0 mttt -124.78 126.3 45.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.07 0.462 . . . . 0.0 111.572 -179.543 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.463 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 56.0 t80 -77.14 149.81 35.61 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.637 179.837 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.799 -179.81 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.189 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.7 tt -172.34 -47.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.715 0.293 . . . . 0.0 111.044 179.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -169.04 -110.71 0.23 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.71 -179.94 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 38.8 mttt 63.41 64.42 0.82 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.001 0.429 . . . . 0.0 110.554 -179.809 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.455 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 17.5 p90 -91.02 -39.19 12.34 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.584 -179.602 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.402 ' CD1' ' CG2' ' A' ' 11' ' ' THR . 8.2 tp -65.45 -14.68 17.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.68 0.276 . . . . 0.0 111.631 -179.447 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -74.91 -24.64 58.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.819 0.342 . . . . 0.0 110.717 179.424 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.4 p -118.65 -2.77 10.91 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.495 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 68.0 m -108.88 150.3 27.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.084 0.469 . . . . 0.0 111.236 -179.526 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.429 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.4 ptm180 -132.18 172.52 12.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.779 -179.861 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.429 ' OD1' ' O ' ' A' ' 9' ' ' ARG . 5.7 p-10 48.71 58.26 5.47 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.908 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.402 ' CG2' ' CD1' ' A' ' 5' ' ' ILE . 42.6 p -79.25 132.15 36.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.75 178.65 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -156.13 163.28 39.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.253 -179.228 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.484 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.8 OUTLIER -97.65 135.7 39.09 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.903 -179.754 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.441 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.54 144.31 48.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.12 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.07 -153.07 31.45 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.764 -1.208 . . . . 0.0 111.321 -178.761 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.55 -37.24 19.83 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -178.243 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.44 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -141.92 36.67 1.59 Allowed 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.201 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.441 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.1 mp0 -114.09 144.29 43.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.968 0.413 . . . . 0.0 111.317 178.617 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.408 ' HB2' HD11 ' A' ' 37' ' ' LEU . 13.4 tp -117.33 123.83 47.47 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.672 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.38 142.17 47.44 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.445 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.01 172.22 17.27 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.152 -178.591 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -116.06 133.58 55.87 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.751 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 32.1 m -130.73 134.52 46.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.131 0.491 . . . . 0.0 111.573 -179.104 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.448 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 4.0 ptpt -66.44 137.73 57.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.464 -179.473 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.9 p -85.06 -175.98 5.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.709 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.9 mmt85 -61.97 -30.46 70.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.809 0.337 . . . . 0.0 111.114 -179.811 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.84 9.04 10.73 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 66.77 38.46 3.82 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.292 0.568 . . . . 0.0 111.393 -178.739 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.448 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 13.9 mm100 -116.95 136.76 52.69 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 177.802 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -93.21 124.7 37.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.839 0.352 . . . . 0.0 111.549 -178.753 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.3 m -129.45 149.23 33.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.672 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.8 m -71.63 134.75 46.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.165 0.507 . . . . 0.0 111.523 -178.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.9 t -142.86 161.26 38.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.337 179.744 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -142.57 155.82 45.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.363 0.601 . . . . 0.0 111.848 -179.25 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.1 tp -135.87 127.19 44.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.721 179.349 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -86.89 115.42 24.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.631 0.253 . . . . 0.0 110.946 -178.526 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' A' ' 17' ' ' SER . 4.7 mp -85.87 -15.97 40.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.457 179.991 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.91 -47.28 74.58 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.366 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.403 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -92.05 -9.83 41.32 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 122.259 -0.275 . . . . 0.0 111.622 179.723 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.437 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 23.8 m-70 -95.69 -67.02 0.87 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.535 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.417 ' CD1' ' CD1' ' A' ' 50' ' ' TRP . 12.9 mm -79.79 148.33 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.486 178.641 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.428 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.03 171.75 13.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.511 -179.753 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.501 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 21.0 t30 -113.16 112.8 24.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.144 -179.158 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.413 ' CD1' ' HB2' ' A' ' 49' ' ' LYS . 2.4 mp -113.25 88.96 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.952 0.406 . . . . 0.0 110.903 179.276 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 43.5 t0 70.89 38.16 1.2 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.075 179.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.72 0.36 89.19 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.161 179.464 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.4 m -110.57 135.71 50.8 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 117.107 0.454 . . . . 0.0 110.943 179.923 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.3 mt -77.61 118.45 20.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.635 0.731 . . . . 0.0 111.508 -178.114 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.413 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 28.4 mttt -137.41 162.75 32.8 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.102 -179.938 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.472 ' CE2' HG11 ' A' ' 90' ' ' VAL . 8.0 m-90 -85.95 119.39 26.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.921 0.391 . . . . 0.0 111.235 -179.648 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.41 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 14.6 tt0 -174.32 148.26 1.28 Allowed Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.344 -179.798 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.41 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 14.2 Cg_exo -66.43 70.28 0.45 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.374 2.049 . . . . 0.0 112.796 -179.061 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.428 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.0 p -162.73 133.67 4.87 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.006 179.026 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -81.19 107.19 13.78 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.991 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.437 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.6 p90 -47.62 -30.84 3.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.479 178.219 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.2 p -47.28 -17.87 0.09 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.874 -179.404 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.1 mm-40 -64.85 -30.75 71.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.648 0.261 . . . . 0.0 111.14 -179.339 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.501 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.7 p -125.86 4.54 7.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.428 179.716 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.5 m -116.84 148.18 41.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.286 0.565 . . . . 0.0 111.992 -178.898 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 43.0 p90 -142.82 157.88 44.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.796 -179.945 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.7 m-20 63.02 45.65 5.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.996 0.427 . . . . 0.0 110.421 -179.097 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 62.9 m -69.96 136.31 50.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.371 179.803 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -140.77 151.23 44.27 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.719 -179.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.484 HG13 ' HB2' ' A' ' 13' ' ' LEU . 26.2 mt -130.32 139.7 50.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-O 121.287 0.565 . . . . 0.0 111.894 -179.901 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -139.36 111.01 7.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.051 178.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.15 -123.12 13.9 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.407 -0.901 . . . . 0.0 111.354 -178.644 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.4 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 22.9 p -102.3 -3.75 26.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.252 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.7 t -101.74 139.85 21.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.987 0.422 . . . . 0.0 111.627 179.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.4 tp -102.2 126.87 49.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.22 179.84 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.0 m -117.17 125.15 50.75 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.3 t -151.92 153.65 34.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.629 0.252 . . . . 0.0 111.422 -178.831 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 25.2 m -94.85 126.26 40.06 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.526 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 76.5 m -126.67 145.38 50.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.381 0.61 . . . . 0.0 112.577 -178.555 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -74.61 137.46 42.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.649 178.362 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -93.2 144.82 24.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.763 0.316 . . . . 0.0 110.553 179.63 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 m -52.21 -26.12 10.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.488 -179.44 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -82.89 0.24 45.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.387 179.9 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.06 136.78 7.45 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.833 179.779 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.33 -166.36 12.15 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 -178.68 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -132.3 142.82 49.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.198 0.499 . . . . 0.0 111.299 -179.453 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -153.97 128.8 9.45 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.104 -179.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -92.45 134.82 34.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.652 -179.255 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 60.2 p -122.03 157.99 30.14 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.357 179.755 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.5 m -122.44 145.86 47.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.754 0.312 . . . . 0.0 111.165 -179.804 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.433 HD12 ' CZ3' ' A' ' 50' ' ' TRP . 11.7 tt -144.13 143.39 23.61 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.176 -179.526 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -96.41 113.35 24.92 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.7 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.413 ' O ' HG21 ' A' ' 90' ' ' VAL . 12.9 mt -96.5 -5.47 39.36 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -178.878 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.455 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 14.0 t-20 -44.71 -28.13 0.58 Allowed 'General case' 0 N--CA 1.467 0.417 0 O-C-N 122.111 -0.368 . . . . 0.0 111.936 -178.581 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 71.5 m -82.19 -39.37 23.25 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.896 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.472 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.4 m -72.89 -53.89 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -177.92 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.467 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.2 mp -82.57 147.73 5.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.935 0.397 . . . . 0.0 111.291 -179.066 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.418 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 6.7 tt0 -138.63 166.63 23.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.229 -178.839 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -107.08 99.77 9.3 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.13 0.49 . . . . 0.0 110.68 -179.769 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.415 HG21 ' CD ' ' A' ' 99' ' ' LYS . 39.2 t -98.33 96.83 5.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.035 179.421 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.8 t0 52.98 33.84 15.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.616 0.246 . . . . 0.0 111.535 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.2 28.6 12.91 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.414 179.397 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.6 t -141.24 135.28 30.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.822 0.344 . . . . 0.0 111.015 -179.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.418 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 67.9 mt -74.49 120.11 19.6 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.045 -179.787 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 10.7 mttm -122.47 139.13 54.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.932 -179.966 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.437 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 69.4 t80 -81.58 -29.46 33.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.579 -179.92 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.876 179.816 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.18 0 N-CA-C 112.556 -0.218 . . . . 0.0 112.556 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 6.9 mt -62.51 -46.05 90.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.914 0.388 . . . . 0.0 110.667 179.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -165.72 -72.61 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.203 179.982 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.1 mmtt 61.18 68.17 0.75 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.814 0.34 . . . . 0.0 110.857 179.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.414 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 18.0 p90 -92.21 -39.86 11.3 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.431 -179.889 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.408 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 7.0 tp -63.41 -19.95 25.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.737 0.303 . . . . 0.0 111.159 -179.834 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -73.96 -24.01 59.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.676 179.25 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 p -118.58 13.96 13.49 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.445 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 62.1 m -130.76 154.72 47.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.992 0.425 . . . . 0.0 111.066 -179.595 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.406 ' NH2' ' CZ ' ' A' ' 30' ' ' PHE . 15.0 ptp180 -132.99 172.73 12.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.04 -179.812 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.427 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.4 p-10 48.51 57.22 6.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.164 179.688 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.9 p -79.24 133.48 36.67 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.255 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.3 pp0? -157.9 163.77 37.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.417 -179.013 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.425 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.43 135.12 39.76 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.949 -179.873 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.42 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.1 144.98 46.31 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 178.796 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.96 -153.24 30.68 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 119.726 -1.226 . . . . 0.0 111.504 -178.955 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.4 -36.57 19.07 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.351 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.82 35.67 1.78 Allowed 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.804 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.42 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 10.7 mp0 -115.95 148.91 39.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.092 0.472 . . . . 0.0 111.985 178.892 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.4 ' HB2' ' CD1' ' A' ' 64' ' ' ILE . 15.4 tp -123.79 124.61 43.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.173 179.012 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.26 143.27 46.7 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.68 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.36 172.63 16.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.463 -178.438 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -113.53 133.51 55.21 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 177.532 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 63.3 m -131.03 134.76 46.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.117 0.484 . . . . 0.0 111.962 -179.082 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -67.27 136.49 55.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.526 -179.613 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.4 p -86.29 -178.9 6.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.521 179.814 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -60.29 -29.22 68.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.785 0.326 . . . . 0.0 110.957 -179.712 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.75 8.53 9.81 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.798 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 66.66 38.13 4.1 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.324 0.583 . . . . 0.0 111.086 -178.692 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.415 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 9.9 mt-30 -119.8 135.57 54.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.039 178.376 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.406 ' CZ ' ' NH2' ' A' ' 9' ' ' ARG . 50.3 m-85 -92.77 124.73 36.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.963 0.411 . . . . 0.0 111.35 -178.981 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.4 m -128.64 151.02 34.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.91 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.4 p -70.95 133.01 46.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.168 0.509 . . . . 0.0 111.835 -178.555 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.2 t -143.4 161.42 38.42 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.323 179.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -143.77 155.28 44.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.231 0.539 . . . . 0.0 111.904 -178.936 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.1 tp -135.44 126.36 44.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.274 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -87.2 117.23 25.81 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.709 0.29 . . . . 0.0 111.136 -178.337 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.408 ' O ' ' N ' ' A' ' 41' ' ' ILE . 3.9 mp -87.74 -15.59 36.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.986 -179.623 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -58.24 -43.5 87.85 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.39 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 4.0 m-20 -91.97 -10.08 40.65 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.024 -0.423 . . . . 0.0 111.195 179.084 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.501 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 25.8 m-70 -96.74 -63.06 1.17 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.633 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.449 HD11 ' CD1' ' A' ' 50' ' ' TRP . 24.1 mm -80.59 149.87 4.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.547 178.443 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.422 ' HB1' ' HB2' ' A' ' 51' ' ' GLN . . . -140.0 172.05 13.32 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.398 -179.773 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.439 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 32.4 t30 -112.7 107.8 16.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.017 -179.021 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 48.0 mm -109.81 91.07 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.182 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.7 t70 66.25 39.58 4.1 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.005 -179.822 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 81.39 1.18 89.97 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.729 179.889 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 m -108.56 137.74 46.01 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.912 0.387 . . . . 0.0 111.253 -179.883 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 20.4 mt -77.19 115.82 17.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.592 0.711 . . . . 0.0 111.341 -178.151 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -137.71 162.83 32.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.201 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.449 ' CD1' HD11 ' A' ' 41' ' ' ILE . 5.8 m-90 -86.67 122.38 30.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.892 0.377 . . . . 0.0 111.717 -179.35 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.422 ' HB2' ' HB1' ' A' ' 42' ' ' ALA . 1.8 mt-30 -172.14 149.52 2.21 Favored Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.133 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.416 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 53.7 Cg_endo -71.66 64.85 3.07 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 121.932 1.754 . . . . 0.0 112.353 -179.811 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.61 134.09 9.74 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.174 179.02 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.422 ' N ' ' OD1' ' A' ' 54' ' ' ASN . 0.2 OUTLIER -81.04 110.13 16.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.509 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.403 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 47.9 p90 -49.25 -30.31 7.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.88 178.529 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.4 p -49.33 -18.15 0.34 Allowed 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -179.025 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -62.21 -28.07 69.43 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.889 -0.324 . . . . 0.0 111.17 -179.104 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.439 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -128.73 -1.89 5.38 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 179.703 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.8 m -108.72 149.43 29.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.125 0.488 . . . . 0.0 112.083 -178.594 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.2 p90 -141.52 157.26 45.35 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.301 179.903 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 64.14 47.68 3.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.84 -179.197 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.406 ' CB ' HD23 ' A' ' 13' ' ' LEU . 55.8 m -70.1 135.38 49.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.788 179.73 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.29 152.32 42.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.714 -179.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.425 HG13 ' HB2' ' A' ' 13' ' ' LEU . 45.7 mt -130.96 140.33 48.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.253 0.549 . . . . 0.0 111.974 -179.724 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -136.26 109.77 7.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.274 179.208 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.47 -119.82 13.6 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.303 -0.951 . . . . 0.0 110.939 -178.457 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.8 p -102.34 -3.29 27.36 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.464 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 t -101.9 136.97 31.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.022 0.439 . . . . 0.0 111.811 179.975 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.3 tp -101.8 125.48 48.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.301 179.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 16.7 m -115.46 126.36 54.23 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -179.859 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.5 t -151.77 153.54 34.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.792 0.33 . . . . 0.0 111.649 -178.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.6 m -95.42 126.02 40.43 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.812 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.9 m -126.19 144.5 50.74 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.598 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -74.31 137.64 43.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.375 178.037 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.2 mtm-85 -91.94 142.37 27.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.668 0.27 . . . . 0.0 110.593 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.2 m -52.21 -27.0 13.03 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.612 -179.361 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -83.05 1.98 37.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.706 0.289 . . . . 0.0 111.393 179.924 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.49 134.07 6.53 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.497 -179.873 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.11 -171.07 13.58 Favored Glycine 0 C--N 1.318 -0.459 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.625 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -132.19 144.19 50.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 117.28 0.54 . . . . 0.0 111.337 -179.905 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -154.39 132.29 11.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.245 179.879 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -94.45 134.44 36.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.306 -179.642 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 38.3 p -120.61 158.28 27.72 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.283 179.711 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.07 144.33 48.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.26 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 13.4 tt -144.51 143.83 22.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.693 179.913 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -98.0 118.31 34.32 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.942 179.524 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 4.8 mt -100.32 -6.05 26.45 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -179.06 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.408 ' ND2' ' CG2' ' A' ' 5' ' ' ILE . 14.1 t-20 -44.63 -28.25 0.58 Allowed 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -178.349 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 13.2 m -82.2 -39.53 22.99 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.44 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.2 m -72.32 -52.62 23.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 N-CA-C 113.445 0.905 . . . . 0.0 113.445 -177.943 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.44 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -81.55 147.3 6.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.131 0.491 . . . . 0.0 111.238 -179.17 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.439 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 15.3 tt0 -137.62 165.63 25.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.061 -178.617 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -107.63 100.16 9.58 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.235 0.54 . . . . 0.0 110.728 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.2 t -98.34 98.44 7.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.78 179.039 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.8 t0 54.17 32.55 16.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.672 0.272 . . . . 0.0 111.41 -179.801 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.49 28.46 11.41 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.316 179.297 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.1 m -140.38 137.35 33.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.918 0.39 . . . . 0.0 111.571 -179.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.439 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 57.0 mt -74.38 119.04 18.04 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.686 179.873 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.428 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.5 mttm -126.57 145.35 50.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.671 -179.112 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.501 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 1.0 OUTLIER -91.55 138.42 31.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.023 179.406 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.232 -0.889 . . . . 0.0 111.003 -179.748 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.181 0 N-CA-C 112.55 -0.22 . . . . 0.0 112.55 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -173.62 -39.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.694 0.283 . . . . 0.0 111.111 -179.938 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -58.46 153.12 28.74 Favored Glycine 0 CA--C 1.52 0.362 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.425 179.652 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -155.1 89.65 1.23 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.786 0.293 . . . . 0.0 111.255 179.915 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.408 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 13.2 p90 -98.42 -39.06 8.96 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.5 tp -62.64 -19.14 22.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.601 0.239 . . . . 0.0 111.544 -179.467 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -74.38 -25.64 59.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.615 0.245 . . . . 0.0 111.037 179.293 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.1 p -118.91 -0.94 11.09 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.641 179.287 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 80.6 m -109.84 151.42 27.03 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.898 0.38 . . . . 0.0 111.279 -179.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.1 172.24 12.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.015 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 48.88 58.76 4.98 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -179.871 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.6 p -79.25 134.07 36.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.84 178.622 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -157.26 163.65 38.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.507 -179.183 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.402 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.7 OUTLIER -97.66 135.42 39.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.097 -179.869 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -118.61 144.17 46.31 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 178.657 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.81 -152.11 32.3 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 119.753 -1.213 . . . . 0.0 111.566 -179.01 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.99 -36.64 18.14 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.413 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.403 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.1 p -140.73 34.87 1.79 Allowed 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -178.588 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -115.36 148.54 39.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.106 0.479 . . . . 0.0 112.06 178.788 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.6 tp -122.31 123.76 42.17 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.46 179.504 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.07 143.97 47.84 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.901 0.381 . . . . 0.0 110.031 179.405 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.6 172.56 16.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.876 -178.539 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -112.56 133.57 54.55 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 176.893 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 58.4 m -130.59 133.57 46.29 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.51 -0.476 . . . . 0.0 112.026 -178.924 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.7 ptpt -66.03 136.95 56.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.664 -179.78 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 63.7 p -85.98 -176.92 6.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.566 179.872 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -61.52 -29.72 70.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.674 0.273 . . . . 0.0 111.183 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.0 8.39 10.71 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.622 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 66.26 38.08 4.69 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.216 0.531 . . . . 0.0 111.196 -178.725 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -118.58 135.83 54.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.664 178.307 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -92.88 124.53 36.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.061 0.458 . . . . 0.0 111.786 -178.518 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.7 m -130.3 151.29 35.65 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.723 -179.983 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.4 t -72.44 136.46 46.01 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.166 0.508 . . . . 0.0 112.079 -178.723 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 t -145.13 161.72 38.8 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.265 179.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt -143.1 157.19 44.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.48 0.657 . . . . 0.0 112.177 -179.215 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -136.74 125.6 36.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.922 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -88.32 119.56 28.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.621 0.248 . . . . 0.0 110.977 -177.93 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 17' ' ' SER . 3.9 mp -88.94 -14.88 35.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.488 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.2 p-10 -57.4 -45.61 84.35 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.222 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.436 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 3.8 p30 -92.83 -10.48 36.64 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.906 -0.496 . . . . 0.0 111.377 178.567 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.47 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 9.5 m-70 -94.29 -66.07 0.94 Allowed 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.959 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.443 ' N ' ' CD1' ' A' ' 41' ' ' ILE . 1.6 mp -81.24 150.64 4.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.938 178.809 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.41 ' HB1' ' HB2' ' A' ' 51' ' ' GLN . . . -140.98 171.68 13.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.808 -179.032 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.404 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 23.7 t30 -113.25 111.52 22.18 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.367 -179.202 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 2.4 mp -112.45 89.32 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-O 120.918 0.389 . . . . 0.0 111.161 179.731 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t0 67.32 38.13 3.37 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.937 179.369 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.54 0.85 87.98 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.473 -0.87 . . . . 0.0 113.158 179.307 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.1 m -112.94 136.48 52.56 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.193 0.496 . . . . 0.0 110.842 179.776 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.9 mt -77.38 117.97 19.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.649 0.738 . . . . 0.0 112.541 -177.521 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.6 mttt -139.61 163.01 33.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.545 179.475 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.436 ' CZ2' HD13 ' A' ' 85' ' ' ILE . 9.5 m-90 -87.7 127.08 35.3 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.892 0.331 . . . . 0.0 111.892 -179.4 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.41 ' HB2' ' HB1' ' A' ' 42' ' ' ALA . 0.1 OUTLIER -172.92 159.14 3.57 Favored Pre-proline 0 N--CA 1.468 0.432 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.686 -179.785 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -77.02 61.55 7.21 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 122.118 1.879 . . . . 0.0 112.142 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.1 p -156.47 135.34 11.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.85 -1.068 . . . . 0.0 108.599 179.193 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.29 109.87 16.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.227 0.536 . . . . 0.0 112.139 -178.182 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -46.41 -30.02 1.96 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.087 178.764 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.6 p -50.65 -17.11 0.47 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -179.049 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -61.2 -29.37 69.77 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.838 -179.308 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.404 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.3 p -129.68 0.63 4.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.531 179.249 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.9 m -110.86 148.3 32.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.3 0.572 . . . . 0.0 112.06 -178.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -141.72 157.53 44.94 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.021 -179.682 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 63.71 45.62 4.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.912 0.387 . . . . 0.0 110.879 -179.356 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 58.1 m -69.01 137.2 53.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.513 179.655 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.58 152.13 41.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.071 -179.433 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.402 HG13 ' HB2' ' A' ' 13' ' ' LEU . 39.9 mt -131.01 140.27 49.05 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 121.302 0.573 . . . . 0.0 112.239 -179.898 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -137.88 110.68 7.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.273 179.271 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.66 -121.71 17.95 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.368 -0.92 . . . . 0.0 111.171 -178.602 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.1 p -100.49 -2.92 31.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.984 0.392 . . . . 0.0 112.002 -179.408 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.4 t -103.57 138.41 28.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -179.633 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.7 tp -102.85 124.64 48.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.615 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.7 m -115.52 126.65 54.54 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -179.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.2 t -151.89 153.8 34.87 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.128 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 8.3 m -95.06 126.42 40.39 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 178.814 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 73.4 m -127.32 146.3 50.49 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -178.266 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -75.82 137.29 40.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.631 178.042 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 47.8 mtm-85 -92.06 146.04 24.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.743 0.306 . . . . 0.0 110.601 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.1 m -51.92 -31.41 28.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.851 -179.169 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -81.74 2.82 28.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.619 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.19 136.27 6.83 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.34 -179.82 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.0 -173.46 14.71 Favored Glycine 0 C--N 1.317 -0.498 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 -178.41 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -131.65 143.24 50.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.398 0.599 . . . . 0.0 111.484 -179.798 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -154.44 130.81 10.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.38 179.563 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.481 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 0.9 OUTLIER -92.46 134.28 35.1 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.157 -179.763 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.6 p -119.72 158.65 26.06 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.383 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.47 144.66 48.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.338 -179.52 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.436 HD13 ' CZ2' ' A' ' 50' ' ' TRP . 11.8 tt -146.97 145.01 19.71 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.577 179.728 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -98.25 118.7 35.47 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.648 179.502 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 7.0 mt -99.72 -6.46 27.07 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -178.738 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.6 t-20 -45.06 -28.61 0.73 Allowed 'General case' 0 N--CA 1.468 0.442 0 O-C-N 122.17 -0.331 . . . . 0.0 111.825 -178.532 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 7.5 m -80.35 -39.61 28.22 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.447 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.0 m -73.5 -52.58 20.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -178.367 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.447 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.1 mp -81.75 147.32 6.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.927 0.394 . . . . 0.0 111.235 -179.174 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -137.16 165.42 26.14 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.179 -178.709 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -106.4 99.83 9.39 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.133 0.492 . . . . 0.0 110.708 -179.651 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.7 t -99.26 96.75 5.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.171 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 15.8 t0 52.7 33.37 13.74 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 179.742 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.23 28.43 11.72 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.748 -0.739 . . . . 0.0 113.206 179.235 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.0 t -141.63 134.31 28.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.779 0.323 . . . . 0.0 111.174 -179.831 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 73.8 mt -74.75 120.34 20.16 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.054 0.454 . . . . 0.0 110.88 179.923 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -123.3 138.97 54.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.281 -179.71 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.47 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 36.2 t80 -83.38 85.77 7.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.476 179.518 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.309 -0.853 . . . . 0.0 110.833 -179.899 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.16 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.9 tt 61.58 97.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.808 0.337 . . . . 0.0 110.781 -179.93 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 92.14 -114.77 4.64 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.321 -179.781 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.9 mttt 59.65 65.54 1.13 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.986 0.422 . . . . 0.0 110.786 179.997 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.449 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 22.7 p90 -89.88 -39.18 13.21 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.289 179.968 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.429 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 6.4 tp -64.46 -16.32 19.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.714 0.292 . . . . 0.0 111.397 -179.871 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -76.04 -24.95 55.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.817 0.342 . . . . 0.0 110.802 179.36 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.4 p -118.29 -4.04 10.96 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.656 179.775 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 60.4 m -109.69 153.64 23.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.161 0.505 . . . . 0.0 111.067 -179.557 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 22.2 ptt180 -132.27 173.03 11.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.615 -179.948 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.402 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.9 p-10 49.12 58.01 5.85 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.011 0.434 . . . . 0.0 112.027 179.867 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.1 p -79.31 130.02 35.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.952 178.801 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -156.15 163.15 39.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.38 -179.403 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.488 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.6 OUTLIER -97.64 136.57 37.82 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.467 179.901 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -121.03 144.6 48.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.071 179.273 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.21 -152.09 29.86 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 119.85 -1.167 . . . . 0.0 111.36 -178.759 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.16 -37.07 19.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.098 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.426 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.34 36.59 1.69 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.92 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 3.2 mp0 -115.71 145.74 42.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.15 0.5 . . . . 0.0 111.512 178.922 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.404 ' HB2' HD12 ' A' ' 37' ' ' LEU . 13.3 tp -119.92 123.79 44.42 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 178.913 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.29 142.89 46.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.876 0.369 . . . . 0.0 110.041 179.595 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.22 172.28 16.96 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.001 -178.795 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -114.39 133.55 55.63 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.69 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 39.4 m -130.61 133.38 46.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.134 0.492 . . . . 0.0 111.709 -179.12 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 3.1 ptpt -66.59 137.99 57.15 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.451 -179.624 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 21.1 p -85.48 -177.13 6.36 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.637 179.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.4 mtt-85 -61.33 -30.35 70.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.298 -179.673 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.77 9.46 9.7 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -179.099 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 66.84 38.34 3.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.223 0.535 . . . . 0.0 111.609 -178.838 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.489 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 16.0 mm100 -116.8 137.68 52.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.811 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -94.65 124.77 38.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.896 0.379 . . . . 0.0 111.883 -178.778 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 23.5 m -130.47 151.47 35.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.914 179.543 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.3 m -72.45 134.87 45.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.223 0.535 . . . . 0.0 111.617 -178.842 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.2 t -141.75 161.51 37.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.002 179.713 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -140.74 154.14 46.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.462 0.649 . . . . 0.0 112.007 -178.895 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -138.36 122.58 21.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.0 -1.0 . . . . 0.0 108.61 179.214 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -86.57 119.14 26.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.824 0.345 . . . . 0.0 110.863 -178.646 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 17' ' ' SER . 4.4 mp -87.0 -15.56 38.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.757 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.447 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -57.49 -45.92 84.31 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.024 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.447 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.3 m-20 -92.13 -10.04 40.33 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 122.101 -0.375 . . . . 0.0 111.53 179.599 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 39.4 m-70 -98.63 -67.45 0.85 Allowed 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.799 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 3.3 mp -81.13 149.71 4.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.407 178.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.417 ' HB1' ' CG ' ' A' ' 51' ' ' GLN . . . -141.4 172.57 12.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.148 -179.37 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.482 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 12.9 t30 -112.45 114.68 27.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.98 179.682 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 49.7 mm -113.41 89.35 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.384 -179.641 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 56.8 t0 71.12 38.53 1.08 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.95 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.41 0.68 88.25 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.889 179.779 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.9 m -115.2 136.29 53.26 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.917 0.389 . . . . 0.0 110.814 179.793 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.6 mt -77.5 120.26 22.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.516 0.674 . . . . 0.0 111.545 -178.16 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -135.37 162.06 33.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.873 179.877 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.45 ' CZ3' HD12 ' A' ' 85' ' ' ILE . 8.0 m-90 -89.2 117.61 28.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.061 0.458 . . . . 0.0 112.193 -179.065 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.417 ' CG ' ' HB1' ' A' ' 42' ' ' ALA . 3.0 pt20 -178.55 151.12 0.72 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.974 178.656 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.426 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 28.4 Cg_endo -63.21 81.98 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.263 1.975 . . . . 0.0 113.118 -178.697 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.414 ' OG ' ' CB ' ' A' ' 42' ' ' ALA . 3.0 p -172.38 131.92 0.61 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.018 178.938 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.81 108.87 15.69 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -177.921 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.426 ' CZ ' ' CB ' ' A' ' 17' ' ' SER . 25.1 p90 -47.91 -29.77 3.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.469 178.544 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.7 p -48.8 -15.92 0.11 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.217 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -64.63 -30.79 71.82 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.599 -178.79 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.482 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -129.75 2.81 4.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.504 0.192 . . . . 0.0 111.301 179.763 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.6 m -112.2 148.03 34.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.207 0.527 . . . . 0.0 111.827 -179.013 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -142.48 157.37 44.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.017 -179.724 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 63.33 47.61 3.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.961 0.41 . . . . 0.0 110.693 -179.187 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.1 m -70.11 136.36 50.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.598 179.865 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.04 152.09 43.04 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.494 179.791 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.488 HG13 ' HB2' ' A' ' 13' ' ' LEU . 34.6 mt -130.28 140.6 48.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.219 0.533 . . . . 0.0 111.649 -179.933 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -137.44 110.6 7.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.236 -0.893 . . . . 0.0 108.99 179.059 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.68 -122.33 16.9 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.24 -0.981 . . . . 0.0 111.179 -178.651 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.402 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 20.8 p -101.18 -4.33 27.43 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -179.521 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 5.5 t -101.74 139.56 22.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.969 0.414 . . . . 0.0 111.691 -179.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.0 tp -102.22 127.82 49.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.356 179.834 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 6.8 m -117.24 124.34 48.82 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.902 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.6 t -151.26 153.32 34.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.686 -0.233 . . . . 0.0 111.159 -178.881 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.9 m -93.14 125.96 38.0 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.015 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.3 m -127.14 144.34 51.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.316 0.579 . . . . 0.0 112.52 -178.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -74.84 138.1 42.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.857 178.454 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 59.5 mtp180 -92.65 143.55 26.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.66 0.267 . . . . 0.0 110.53 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.2 m -51.83 -25.63 8.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.565 -0.288 . . . . 0.0 111.448 -179.429 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -82.79 0.84 41.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.762 0.315 . . . . 0.0 111.442 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.36 135.86 6.73 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.437 -179.935 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.55 -168.49 12.76 Favored Glycine 0 C--N 1.319 -0.386 0 N-CA-C 111.298 -0.721 . . . . 0.0 111.298 -178.742 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -131.19 141.63 50.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 117.145 0.473 . . . . 0.0 111.246 -179.626 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -154.28 130.71 10.54 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.26 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -93.35 134.37 35.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.303 -179.478 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 p -120.9 158.47 27.59 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.902 0.382 . . . . 0.0 110.542 179.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 60.5 p -120.6 143.74 48.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.45 HD12 ' CZ3' ' A' ' 50' ' ' TRP . 14.4 tt -144.51 142.07 23.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.382 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -96.31 116.6 29.28 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.213 179.876 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.432 ' O ' HG23 ' A' ' 90' ' ' VAL . 10.0 mt -96.64 -6.64 36.18 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -179.025 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.449 ' HA ' ' CE1' ' A' ' 4' ' ' PHE . 12.1 t-20 -44.99 -29.48 0.84 Allowed 'General case' 0 N--CA 1.466 0.355 0 O-C-N 122.186 -0.322 . . . . 0.0 111.705 -178.652 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.75 -41.0 24.24 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.947 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.467 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.2 m -71.01 -53.19 22.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 113.358 0.874 . . . . 0.0 113.358 -177.91 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.467 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.81 147.79 5.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.992 0.425 . . . . 0.0 111.568 -178.836 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 13.4 tt0 -137.02 165.66 25.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.866 -179.074 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -107.57 99.71 9.19 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.112 0.482 . . . . 0.0 110.25 179.837 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 0.41 HG22 ' CG ' ' A' ' 99' ' ' LYS . 38.9 t -98.81 96.69 5.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.136 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.8 t0 52.75 33.99 15.23 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.716 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.5 28.07 12.05 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.845 -0.693 . . . . 0.0 113.389 179.155 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.1 t -141.89 135.46 29.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.789 0.328 . . . . 0.0 111.401 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.407 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 64.3 mt -73.59 119.26 17.57 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.425 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.41 ' CG ' HG22 ' A' ' 94' ' ' VAL . 8.0 mttm -125.29 148.63 48.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.647 -178.995 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -95.19 81.28 3.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.902 -179.841 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.961 179.985 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 112.519 -0.233 . . . . 0.0 112.519 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 12.8 tp 64.83 140.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.828 0.347 . . . . 0.0 111.111 179.988 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 104.17 -107.76 3.02 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.019 -179.77 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 63.54 68.58 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.834 0.349 . . . . 0.0 111.336 179.36 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -92.49 -37.89 12.26 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.194 179.584 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.404 ' CG2' ' ND2' ' A' ' 88' ' ' ASN . 3.9 tp -66.06 -13.64 16.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.727 0.299 . . . . 0.0 111.101 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -77.34 -27.36 52.74 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.016 0.436 . . . . 0.0 109.874 178.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 42.6 p -118.74 11.22 12.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.138 178.755 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.7 m -124.94 149.88 47.18 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.153 0.501 . . . . 0.0 111.616 -179.043 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -133.64 173.0 11.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.797 179.764 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 p30 49.99 56.91 7.16 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.792 0.437 . . . . 0.0 112.07 -179.743 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.402 ' CG2' ' CD1' ' A' ' 5' ' ' ILE . 25.0 p -79.27 133.8 36.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.898 178.588 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -157.09 163.68 38.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.571 -179.166 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.461 ' HB2' HG13 ' A' ' 64' ' ' ILE . 0.7 OUTLIER -97.7 136.08 38.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.905 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.92 144.31 48.51 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.1 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.67 -152.92 34.07 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 119.866 -1.159 . . . . 0.0 111.281 -178.859 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.57 -37.05 20.02 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.427 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -142.09 35.61 1.54 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -179.085 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 2.1 mp0 -113.28 147.27 37.91 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.959 0.409 . . . . 0.0 111.511 178.604 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.401 ' HB2' HD11 ' A' ' 37' ' ' LEU . 11.9 tp -119.65 124.79 47.14 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.983 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.01 143.32 49.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.531 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.65 172.64 15.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.187 -178.795 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -111.2 133.85 53.23 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.044 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.3 m -130.82 133.98 46.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.124 0.488 . . . . 0.0 111.881 -179.089 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.421 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 8.3 ptpt -66.03 136.79 56.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.382 -179.606 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.8 p -85.45 -176.29 6.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.52 179.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 39.4 mtm180 -61.54 -30.68 70.8 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.642 0.258 . . . . 0.0 111.316 -179.615 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.86 9.89 10.97 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.097 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 66.57 39.45 3.75 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.263 0.554 . . . . 0.0 111.614 -178.795 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.421 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 50.0 mt-30 -117.12 136.44 53.0 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.565 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -92.56 124.33 36.51 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.614 -178.688 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.6 m -128.89 149.08 33.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.354 179.448 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.7 m -72.36 136.7 46.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.269 0.557 . . . . 0.0 111.616 -178.847 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -142.17 161.21 38.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.148 179.668 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.9 154.22 47.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.394 0.616 . . . . 0.0 112.012 -179.379 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -136.89 126.43 37.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.096 -0.957 . . . . 0.0 108.858 179.656 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -87.94 115.52 25.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.609 0.243 . . . . 0.0 111.622 -178.032 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 17' ' ' SER . 3.8 mp -87.03 -16.33 35.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.22 179.359 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.66 -45.13 81.86 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.691 0.281 . . . . 0.0 111.399 -178.863 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.413 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -92.05 -10.49 38.95 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 122.241 -0.287 . . . . 0.0 111.617 179.633 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.487 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 17.7 m-70 -97.43 -64.47 1.04 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.441 HD11 ' CD1' ' A' ' 50' ' ' TRP . 29.8 mm -79.77 148.05 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.645 179.026 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.411 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -140.01 172.04 13.33 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.603 -179.775 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.449 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 32.9 t30 -113.02 111.23 21.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.378 -178.939 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.418 ' N ' ' CD1' ' A' ' 44' ' ' ILE . 2.2 mp -111.21 89.49 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.915 179.289 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.1 t70 67.95 38.14 2.87 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.105 -179.958 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.71 2.39 88.71 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.627 -0.797 . . . . 0.0 113.231 179.448 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.2 m -111.5 136.32 50.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.201 0.501 . . . . 0.0 111.162 -179.946 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.1 mt -77.5 117.47 18.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.616 0.722 . . . . 0.0 111.384 -178.199 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.41 ' HB2' ' CD1' ' A' ' 44' ' ' ILE . 8.9 mttm -138.45 163.01 33.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.128 -179.841 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' TRP . . . . . 0.441 ' CD1' HD11 ' A' ' 41' ' ' ILE . 7.3 m-90 -85.91 119.82 26.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.991 0.424 . . . . 0.0 111.493 -179.464 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.456 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 40.5 tt0 -174.99 143.52 0.77 Allowed Pre-proline 0 N--CA 1.463 0.221 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.359 -179.983 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.456 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 29.6 Cg_endo -64.68 72.09 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 122.289 1.993 . . . . 0.0 112.868 -179.171 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.411 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.9 p -163.44 133.8 4.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.4 178.932 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.47 ' N ' ' OD1' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.41 109.88 15.33 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.682 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.421 ' CD1' ' N ' ' A' ' 56' ' ' SER . 12.7 p90 -50.09 -30.47 11.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.721 178.522 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.421 ' N ' ' CD1' ' A' ' 55' ' ' PHE . 77.3 p -48.4 -19.63 0.33 Allowed 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -179.196 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -60.49 -26.29 66.71 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.944 -0.302 . . . . 0.0 111.073 -179.096 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.449 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -132.08 0.29 3.8 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.501 179.204 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.3 m -110.95 148.35 32.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.159 0.504 . . . . 0.0 111.912 -178.75 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -143.47 157.79 44.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.081 -179.739 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 64.6 45.46 3.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.922 0.391 . . . . 0.0 110.884 -179.41 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 68.1 m -69.54 136.29 51.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.777 179.893 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.24 150.51 42.73 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.318 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.461 HG13 ' HB2' ' A' ' 13' ' ' LEU . 35.2 mt -129.13 138.98 53.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.301 0.572 . . . . 0.0 111.631 179.93 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -136.27 110.22 8.22 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.374 179.265 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.85 -121.09 13.58 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.403 -0.903 . . . . 0.0 110.982 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 26.9 p -101.85 -5.7 24.47 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -179.259 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 6.5 t -101.03 141.28 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.075 0.465 . . . . 0.0 111.773 179.693 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.4 tp -103.96 126.63 51.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.565 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.5 m -116.05 125.88 53.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.325 -179.956 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.3 t -151.7 153.83 35.14 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.625 0.25 . . . . 0.0 111.336 -179.294 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.2 m -94.08 125.95 39.02 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.651 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 93.0 m -124.53 142.89 51.0 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -178.41 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -73.14 137.06 44.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.657 178.42 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -92.29 142.42 27.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.632 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 m -52.05 -29.23 20.37 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.476 -179.499 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -82.45 1.27 38.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.45 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.35 135.81 7.61 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.99 179.646 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.07 -169.89 13.14 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -131.27 142.66 50.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.32 0.56 . . . . 0.0 111.142 -179.899 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -153.84 128.18 9.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.029 -179.697 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.517 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 5.2 t -92.64 134.96 34.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.685 -179.028 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 64.1 p -121.33 158.38 28.35 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.375 179.954 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.0 m -122.83 144.81 48.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.976 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 12.0 tt -144.91 142.83 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.815 -179.818 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -95.3 115.46 27.46 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.93 179.597 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.409 ' O ' HG23 ' A' ' 90' ' ' VAL . 14.9 mt -97.01 -5.29 38.06 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -179.343 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.404 ' ND2' ' CG2' ' A' ' 5' ' ' ILE . 9.0 t-20 -44.42 -28.95 0.62 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.447 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 64.5 m -82.23 -38.07 25.05 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.749 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . 0.448 ' CG2' ' N ' ' A' ' 91' ' ' ILE . 3.1 m -74.09 -52.96 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -177.996 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.448 ' N ' ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.59 146.41 7.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.032 0.444 . . . . 0.0 111.292 -179.161 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 99' ' ' LYS . 22.1 tt0 -137.38 167.07 22.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.077 -178.851 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -107.18 99.43 8.97 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.131 0.491 . . . . 0.0 110.501 -179.745 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.5 t -97.77 95.88 4.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.826 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.9 t0 54.16 33.8 18.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.659 0.266 . . . . 0.0 111.549 179.939 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.37 28.55 12.76 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.97 179.631 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.5 t -139.82 134.25 31.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.85 0.357 . . . . 0.0 111.187 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.405 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 71.8 mt -73.51 120.09 18.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.57 179.951 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.409 ' O ' ' N ' ' A' ' 92' ' ' GLU . 18.8 mttt -124.93 130.95 53.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.565 -178.927 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' TYR . . . . . 0.487 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 26.3 t80 -79.81 -33.6 40.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.365 179.636 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.274 -0.869 . . . . 0.0 110.79 179.756 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 33.5 p90 . . . . . 0 N--CA 1.462 0.159 0 CA-C-O 120.912 0.387 . . . . 0.26000000000000001 110.661 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.835 HG22 ' OD1' ' A' ' 88' ' ' ASN . 2.2 tp -63.03 -19.42 23.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 0.20999999999999999 111.569 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -75.65 -27.25 58.3 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.904 -0.318 . . . . 2.0099999999999998 111.151 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 50.6 p -118.78 14.11 13.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.519 -0.31 . . . . 0.33000000000000002 111.501 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.2 m -129.67 151.32 50.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.067 0.461 . . . . 0.17000000000000001 111.353 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.62 172.83 12.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.715 -0.675 . . . . 2.5600000000000001 110.723 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.44 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 4.9 p-10 49.16 56.05 8.38 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.211 -0.45 . . . . 1.24 111.875 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.1 p -79.19 134.1 36.69 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.733 -0.469 . . . . 0.34000000000000002 109.733 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.757 ' O ' HD12 ' A' ' 19' ' ' LEU . 15.3 pt20 -157.26 163.41 38.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.125 -0.489 . . . . 1.3500000000000001 111.511 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.68 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.35 136.56 37.65 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.713 -0.676 . . . . 0.089999999999999997 110.958 -179.664 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.58 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.1 146.29 46.08 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.319 -0.855 . . . . 0.10000000000000001 109.324 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.21 -152.64 24.5 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.002 -1.094 . . . . 0.11 111.438 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.52 -36.41 18.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.014 0.407 . . . . 0.13 111.352 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.538 ' OG ' ' HB3' ' A' ' 38' ' ' ASP . 8.0 p -144.71 72.17 1.33 Allowed 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.509 -0.923 . . . . 0.16 108.509 179.357 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.58 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 4.5 mp0 -146.13 141.19 27.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.538 -0.756 . . . . 1.1299999999999999 111.508 176.204 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.757 HD12 ' O ' ' A' ' 12' ' ' GLN . 21.2 tp -121.45 120.98 36.52 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.102 -0.703 . . . . 0.12 109.102 177.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.42 144.33 45.1 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.712 -0.477 . . . . 0.089999999999999997 109.712 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.56 172.51 16.24 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.061 -0.518 . . . . 0.10000000000000001 110.729 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -112.83 133.25 54.91 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.163 -1.051 . . . . 1.5800000000000001 108.163 176.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 59.0 m -131.0 136.39 48.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.228 0.537 . . . . 0.14000000000000001 112.025 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 5.4 ptpt -68.03 135.22 51.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.465 -0.789 . . . . 0.79000000000000004 111.632 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.7 p -87.03 -175.43 5.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.246 -0.888 . . . . 0.17000000000000001 110.617 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -59.16 -33.73 71.26 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.604 0.594 . . . . 2.98 112.604 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.45 11.67 8.2 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.554 0.576 . . . . 0.17000000000000001 112.554 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 67.09 41.86 2.51 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.589 0.709 . . . . 1.8300000000000001 110.497 -178.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.479 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 11.5 mt-30 -116.68 132.63 56.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.692 -1.14 . . . . 1.9199999999999999 108.513 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.408 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 77.4 m-85 -90.66 124.21 34.89 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.495 -0.482 . . . . 0.96999999999999997 110.727 -179.416 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.7 m -122.29 160.89 23.89 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-O 120.974 0.416 . . . . 0.16 111.584 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.46 126.5 31.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.844 -0.616 . . . . 1.28 111.151 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.5 t -140.42 157.46 45.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.327 -0.397 . . . . 0.13 110.779 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -145.9 142.35 28.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.236 0.541 . . . . 1.6000000000000001 112.106 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.445 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.9 tp -118.57 126.62 75.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.367 -0.833 . . . . 0.11 108.77 178.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -87.3 118.64 26.87 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 122.271 -0.268 . . . . 0.94999999999999996 110.672 -178.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.723 HD22 HD22 ' A' ' 69' ' ' LEU . 4.7 mp -87.56 -16.05 35.71 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.353 0.501 . . . . 0.11 112.353 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.538 ' HB3' ' OG ' ' A' ' 17' ' ' SER . 23.3 p30 -56.07 -45.38 79.33 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.582 0.586 . . . . 1.8899999999999999 112.582 -177.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.533 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 2.5 p30 -91.37 -10.25 41.87 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 122.261 -0.274 . . . . 1.6599999999999999 111.699 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 17.3 m80 -97.32 -64.21 1.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.747 -0.464 . . . . 0.23999999999999999 109.747 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.487 HG13 HD23 ' A' ' 37' ' ' LEU . 25.6 mm -81.01 151.27 4.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.85 -0.614 . . . . 1.0 111.358 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.507 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.15 172.18 13.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.495 -0.775 . . . . 0.14999999999999999 111.327 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.611 ' CG ' ' HG1' ' A' ' 58' ' ' THR . 23.4 t-20 -111.34 110.91 21.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.943 -0.571 . . . . 0.14999999999999999 110.614 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.6 mm -110.39 92.34 2.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.947 -0.569 . . . . 1.0 112.004 -179.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 20.4 t0 62.65 37.18 13.06 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.777 0.323 . . . . 1.1299999999999999 111.252 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.491 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 85.26 0.79 88.5 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.612 -0.804 . . . . 0.14000000000000001 112.942 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.5 m -113.18 135.5 53.75 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.982 0.391 . . . . 0.20000000000000001 110.649 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.401 HD12 ' OG ' ' A' ' 83' ' ' SER . 21.2 mt -77.04 118.72 19.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.604 0.716 . . . . 0.20000000000000001 110.95 -178.367 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -137.15 162.51 33.23 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 114.654 -1.157 . . . . 1.3300000000000001 110.042 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.798 ' CH2' HD11 ' A' ' 85' ' ' ILE . 9.7 m-90 -85.54 119.15 25.57 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.999 0.428 . . . . 0.26000000000000001 111.466 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.507 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 13.1 tt0 -174.9 141.22 0.69 Allowed Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.829 -0.623 . . . . 1.79 110.131 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -66.07 70.18 0.4 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.195 1.93 . . . . 0.40000000000000002 112.979 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.46 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.0 p -155.08 137.32 14.83 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.831 -1.077 . . . . 0.26000000000000001 108.154 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.406 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.5 OUTLIER -80.95 104.2 11.3 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.097 0.777 . . . . 0.81000000000000005 113.097 -176.806 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.528 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 44.2 p90 -51.9 -36.59 49.35 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.195 -0.911 . . . . 0.52000000000000002 110.108 177.781 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 77.5 p -45.82 -25.1 0.46 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 114.938 -1.028 . . . . 0.27000000000000002 112.939 -178.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -66.27 -20.24 66.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.676 0.275 . . . . 1.73 111.352 -179.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.611 ' HG1' ' CG ' ' A' ' 43' ' ' ASN . 30.1 p -128.69 6.71 5.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.485 -0.325 . . . . 0.17000000000000001 111.007 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.2 m -126.45 149.67 49.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.209 0.528 . . . . 0.10000000000000001 111.703 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.3 p90 -142.42 157.86 44.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.319 -0.855 . . . . 0.95999999999999996 109.817 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 54.1 m-20 63.38 46.65 4.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.096 0.474 . . . . 0.94999999999999996 110.639 -179.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.68 ' O ' HD22 ' A' ' 13' ' ' LEU . 46.1 m -69.37 135.11 49.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.847 -0.615 . . . . 0.14999999999999999 110.178 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.431 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -141.96 150.04 40.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.493 . . . . 0.11 111.703 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.542 HG13 ' HB2' ' A' ' 13' ' ' LEU . 38.6 mt -130.45 142.44 43.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.222 0.534 . . . . 0.11 111.86 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -139.64 111.93 7.64 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.253 -0.885 . . . . 1.7 108.847 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.571 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 66.75 -122.97 21.32 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.242 -0.98 . . . . 0.12 111.58 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.602 ' N ' HD13 ' A' ' 5' ' ' ILE . 82.5 p -100.36 -5.64 26.99 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.492 0.553 . . . . 0.14999999999999999 112.492 -178.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.479 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.6 t -102.8 139.87 22.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 121.052 0.453 . . . . 0.14000000000000001 111.692 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.723 HD22 HD22 ' A' ' 37' ' ' LEU . 7.1 tp -102.25 126.95 49.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.824 -0.625 . . . . 0.12 110.89 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.51 ' N ' HD12 ' A' ' 69' ' ' LEU . 4.5 m -116.04 123.99 49.32 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.962 -0.385 . . . . 0.14000000000000001 109.962 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.425 ' O ' ' HA ' ' A' ' 82' ' ' THR . 11.2 t -151.54 153.38 34.43 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.253 -0.179 . . . . 0.12 111.245 -178.91 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.57 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 15.6 m -95.72 126.47 41.01 Favored 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 109.832 -0.433 . . . . 0.14999999999999999 109.832 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.577 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 72.3 m -126.87 145.85 50.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.361 0.6 . . . . 0.10000000000000001 112.17 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -74.96 139.08 42.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.167 -0.924 . . . . 1.26 111.113 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -91.32 145.0 25.01 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.915 -0.402 . . . . 3.3500000000000001 109.915 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 34.9 m -51.46 -32.1 25.74 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.466 0.543 . . . . 0.26000000000000001 112.466 -178.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -83.58 4.6 27.52 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.04 0.385 . . . . 1.71 112.04 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.15 136.94 8.02 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.668 -0.777 . . . . 0.16 113.106 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 119.55 -174.58 15.52 Favored Glycine 0 N--CA 1.451 -0.337 0 N-CA-C 110.94 -0.864 . . . . 0.16 110.94 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -130.63 140.88 50.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.383 0.592 . . . . 0.75 111.032 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -154.16 131.04 10.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.139 -0.482 . . . . 1.1599999999999999 110.421 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.57 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.3 t -93.71 134.67 35.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.14999999999999999 111.118 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.401 ' OG ' HD12 ' A' ' 48' ' ' LEU . 53.1 p -120.19 158.03 27.83 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.191 -0.459 . . . . 0.32000000000000001 110.446 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.49 144.48 49.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.977 0.418 . . . . 1.0700000000000001 111.045 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.798 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.0 tt -145.79 143.16 21.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.939 -0.573 . . . . 0.72999999999999998 111.448 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -98.88 120.14 38.83 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.383 -0.371 . . . . 1.1799999999999999 110.935 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.667 ' HB3' HD12 ' A' ' 91' ' ' ILE . 11.4 mt -100.28 -3.59 31.06 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.51 0.93 . . . . 0.19 113.51 -178.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.835 ' OD1' HG22 ' A' ' 5' ' ' ILE . 50.3 t30 -44.69 -28.97 0.68 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.038 0.381 . . . . 0.23999999999999999 111.755 -178.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 37.1 m -84.02 -39.3 19.81 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.575 0.583 . . . . 1.0700000000000001 112.575 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.78 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.0 m -73.24 -49.22 39.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.946 0.721 . . . . 0.20000000000000001 112.946 -178.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.667 HD12 ' HB3' ' A' ' 87' ' ' LEU . 2.7 mt -85.07 147.58 5.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.655 0.264 . . . . 0.14000000000000001 110.662 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 23.5 tt0 -137.49 163.04 32.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.817 -0.438 . . . . 1.1699999999999999 109.817 -179.136 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -107.12 100.23 9.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.22 0.533 . . . . 0.23000000000000001 110.184 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 18.8 t -100.37 98.56 7.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.45 -0.795 . . . . 0.16 111.825 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.3 t0 53.44 33.66 16.47 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.108 0.41 . . . . 0.23999999999999999 112.108 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.76 27.03 15.24 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.638 -0.792 . . . . 0.12 113.08 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -141.85 134.04 27.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.693 0.282 . . . . 1.23 110.95 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.487 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 62.6 mt -74.24 122.7 23.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.445 -0.343 . . . . 0.19 110.673 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -122.65 143.07 50.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.976 0.417 . . . . 1.5 111.488 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 45.6 t80 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 115.924 -0.58 . . . . 1.4399999999999999 110.734 179.925 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.41 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 15.0 p90 . . . . . 0 N--CA 1.465 0.296 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.745 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.0 tp -61.86 -21.28 25.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.609 0.242 . . . . 0.0 111.379 -179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.49 -26.73 51.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.7 0.286 . . . . 0.0 110.615 179.05 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.0 p -118.75 18.73 13.32 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.814 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.0 m -135.69 153.87 51.46 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.895 0.379 . . . . 0.0 111.165 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 ptm85 -131.46 172.72 11.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.994 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 48.87 58.14 5.65 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.621 HG21 ' CD1' ' A' ' 5' ' ' ILE . 43.9 p -79.46 134.31 36.53 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.603 ' O ' HD12 ' A' ' 19' ' ' LEU . 27.1 pt20 -158.09 163.68 37.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.605 -179.032 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.707 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.42 135.9 38.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.244 0.545 . . . . 0.0 110.944 -179.96 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.8 144.84 47.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.141 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.58 -152.8 29.93 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 119.739 -1.22 . . . . 0.0 111.486 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.47 -36.86 18.8 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -140.86 35.74 1.77 Allowed 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -178.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -115.87 148.06 40.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.135 0.493 . . . . 0.0 111.951 178.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.806 ' CB ' HD11 ' A' ' 37' ' ' LEU . 8.6 tp -121.57 124.95 45.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.184 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.09 144.08 48.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.99 0.424 . . . . 0.0 110.206 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.55 172.47 16.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.851 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -112.02 134.86 53.31 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 176.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 82.5 m -130.71 135.07 47.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.206 0.527 . . . . 0.0 112.337 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.06 135.15 53.22 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.438 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.474 HG22 ' O ' ' A' ' 95' ' ' ASP . 79.8 p -84.84 -177.7 6.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.366 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -60.37 -30.64 69.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.768 0.318 . . . . 0.0 111.361 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.06 10.34 8.31 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 66.41 36.05 5.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.11 0.481 . . . . 0.0 111.117 -178.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -115.94 136.32 53.15 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -93.98 125.08 38.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.122 0.487 . . . . 0.0 112.19 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.9 m -131.46 148.5 32.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.623 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.4 m -69.85 136.59 50.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.219 0.533 . . . . 0.0 111.809 -178.545 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.9 t -143.24 161.64 37.75 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.03 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -142.92 156.89 44.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.483 0.658 . . . . 0.0 112.226 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.458 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -138.08 126.32 30.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.894 -1.048 . . . . 0.0 108.612 179.447 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -89.28 118.76 29.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.793 0.33 . . . . 0.0 110.761 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.806 HD11 ' CB ' ' A' ' 19' ' ' LEU . 4.0 mp -87.99 -14.66 38.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.329 -0.396 . . . . 0.0 112.028 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.438 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.9 p-10 -57.68 -44.39 85.76 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -178.285 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.438 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 5.9 p30 -92.6 -10.94 35.65 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 122.089 -0.382 . . . . 0.0 111.542 178.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.466 ' HB3' HD12 ' A' ' 41' ' ' ILE . 19.6 m-70 -96.69 -66.34 0.91 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.609 HD12 ' N ' ' A' ' 41' ' ' ILE . 2.1 mp -81.09 150.47 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.001 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.466 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.1 172.14 13.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.809 -178.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.661 HD22 ' HA2' ' A' ' 46' ' ' GLY . 27.7 t-20 -112.75 111.56 22.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.323 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 41.4 mm -110.82 90.25 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.383 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 66.93 38.97 3.44 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.932 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.661 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 83.01 5.38 89.34 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.778 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.4 m -115.96 135.23 54.17 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.912 0.356 . . . . 0.0 110.522 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 19.4 mt -77.39 118.84 20.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.688 0.756 . . . . 0.0 111.58 -177.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -137.97 162.95 32.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.493 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.734 ' CE2' HG11 ' A' ' 90' ' ' VAL . 8.5 m-90 -86.79 121.05 28.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.869 0.366 . . . . 0.0 111.28 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.467 ' O ' ' N ' ' A' ' 53' ' ' SER . 11.8 tt0 -174.89 143.06 0.76 Allowed Pre-proline 0 N--CA 1.464 0.267 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.491 -179.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -62.98 68.37 0.14 Allowed 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.336 2.024 . . . . 0.0 112.994 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.467 ' N ' ' O ' ' A' ' 51' ' ' GLN . 4.7 p -158.96 131.73 6.97 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.422 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.71 109.96 15.74 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -177.543 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -48.0 -30.49 4.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.927 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 62.8 p -49.92 -19.04 0.61 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -179.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 53.5 mm-40 -61.43 -29.41 69.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.576 0.227 . . . . 0.0 110.895 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.9 p -127.95 0.3 5.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.537 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -113.09 148.09 35.97 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.39 0.614 . . . . 0.0 112.295 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -142.07 157.58 44.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.831 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 64.02 44.87 4.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.99 0.424 . . . . 0.0 110.342 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.707 ' O ' HD22 ' A' ' 13' ' ' LEU . 10.2 m -69.16 138.17 53.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.5 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -145.28 153.21 41.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.529 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.406 ' CD1' ' HB2' ' A' ' 19' ' ' LEU . 27.5 mt -129.55 139.4 51.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.193 0.521 . . . . 0.0 111.537 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -133.39 107.92 8.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.172 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.15 -119.73 11.03 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.44 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.2 p -102.91 -3.08 26.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.004 0.402 . . . . 0.0 111.87 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.46 HG13 ' O ' ' A' ' 85' ' ' ILE . 8.0 t -102.32 138.87 24.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-O 121.097 0.475 . . . . 0.0 111.962 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.713 HD22 HD22 ' A' ' 37' ' ' LEU . 3.1 tp -100.43 126.17 46.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.914 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.663 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.4 m -116.85 124.41 49.45 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.231 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.3 t -152.37 153.85 34.45 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 10.4 m -93.41 125.9 38.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.818 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.491 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 90.8 m -124.91 143.95 50.59 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -178.223 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLU . . . . . 0.413 ' HG3' ' CE1' ' A' ' 80' ' ' TYR . 16.2 tt0 -74.34 136.14 42.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.894 178.319 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 6.4 mtm180 -91.83 142.55 27.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.685 0.279 . . . . 0.0 110.68 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.8 m -51.9 -27.09 11.73 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.7 -179.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -83.12 2.59 34.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.786 0.327 . . . . 0.0 111.284 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.86 135.85 6.49 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.542 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.27 -170.03 13.11 Favored Glycine 0 C--N 1.318 -0.418 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 -178.502 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.413 ' CE1' ' HG3' ' A' ' 74' ' ' GLU . 18.3 m-85 -131.86 143.18 49.98 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 117.411 0.605 . . . . 0.0 111.56 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -153.94 130.07 10.36 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.471 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.6 t -91.86 135.3 34.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.686 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 85.9 p -124.23 158.05 33.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.256 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.75 144.41 49.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.844 0.354 . . . . 0.0 111.092 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.729 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.5 tt -144.71 142.56 23.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.291 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -97.63 117.79 32.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.646 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.613 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 5.8 mt -98.54 -5.16 32.66 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.745 ' OD1' HG22 ' A' ' 5' ' ' ILE . 42.1 t30 -45.37 -27.99 0.78 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 122.151 -0.343 . . . . 0.0 111.754 -178.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.71 -40.38 25.43 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.734 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.3 m -73.47 -53.15 18.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.598 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.1 mp -80.85 147.95 5.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.972 0.415 . . . . 0.0 111.202 -179.44 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' A' ' 99' ' ' LYS . 15.2 tt0 -138.07 164.63 28.62 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.838 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -106.42 99.66 9.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.309 0.576 . . . . 0.0 110.365 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 39.2 t -98.98 97.14 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.92 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.474 ' O ' HG22 ' A' ' 25' ' ' THR . 23.2 t0 53.98 31.8 14.19 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.68 0.276 . . . . 0.0 111.565 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.11 28.22 11.15 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.794 -0.717 . . . . 0.0 113.414 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 42.5 m -139.76 136.35 34.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.882 0.372 . . . . 0.0 111.138 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.409 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 77.0 mt -74.04 119.36 18.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.648 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.418 ' O ' ' N ' ' A' ' 92' ' ' GLU . 4.1 mmmt -125.99 137.14 53.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.984 0.421 . . . . 0.0 111.966 -179.136 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.45 ' CD2' ' CE1' ' A' ' 40' ' ' HIS . 19.5 t80 . . . . . 0 C--N 1.332 -0.16 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.314 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.453 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 16.1 p90 . . . . . 0 N--CA 1.464 0.228 0 CA-C-O 120.688 0.28 . . . . 0.0 111.545 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.792 HG22 ' OD1' ' A' ' 88' ' ' ASN . 6.4 tp -62.24 -21.27 26.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.615 0.245 . . . . 0.0 111.389 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -76.66 -27.33 55.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.742 0.306 . . . . 0.0 111.033 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 50.1 p -118.9 18.37 13.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.664 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 77.8 m -131.42 155.08 47.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.057 0.456 . . . . 0.0 111.545 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -132.51 172.95 11.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.889 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.0 p30 48.82 58.1 5.68 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.566 HG21 ' CD1' ' A' ' 5' ' ' ILE . 40.2 p -79.49 130.77 35.71 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.653 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.4 pt20 -157.05 163.26 39.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.417 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.747 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.86 136.42 38.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.822 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.45 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.06 145.52 46.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.345 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.27 -152.28 33.78 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.788 -1.196 . . . . 0.0 111.325 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.19 -37.17 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.461 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.63 35.36 1.63 Allowed 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.8 OUTLIER -113.71 147.9 37.36 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.937 0.399 . . . . 0.0 111.662 179.016 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.819 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.4 tp -120.11 123.61 43.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.397 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.63 143.69 48.54 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.49 172.51 16.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.214 -178.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -110.07 134.12 52.49 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.484 ' SG ' HD21 ' A' ' 98' ' ' LEU . 75.0 m -130.67 132.91 45.68 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.385 -0.526 . . . . 0.0 112.082 -178.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.5 ptpt -66.93 136.33 55.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.357 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.413 HG22 ' O ' ' A' ' 95' ' ' ASP . 71.2 p -85.21 -176.91 6.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.49 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -62.29 -29.71 70.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.229 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.96 10.35 8.1 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 66.9 38.36 3.68 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.12 0.486 . . . . 0.0 111.511 -178.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.466 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 3.0 mm-40 -118.28 135.92 54.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.979 178.071 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -93.07 124.85 37.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.8 0.333 . . . . 0.0 111.444 -178.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.5 m -130.99 151.78 36.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.896 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.8 p -71.5 134.29 46.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.173 0.511 . . . . 0.0 111.916 -178.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 t -144.17 161.37 39.04 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.368 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -143.7 156.64 44.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.298 0.571 . . . . 0.0 111.893 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.485 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -136.57 127.59 42.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.302 -0.863 . . . . 0.0 108.977 179.608 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -87.49 116.98 25.98 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.699 0.285 . . . . 0.0 111.531 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.897 HD22 HD22 ' A' ' 69' ' ' LEU . 3.9 mp -87.59 -14.84 39.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.91 179.106 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.433 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -56.59 -48.24 77.82 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.297 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.419 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -90.96 -10.08 43.68 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 122.13 -0.356 . . . . 0.0 111.384 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 -95.21 -62.98 1.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.603 HD11 HD22 ' A' ' 87' ' ' LEU . 22.7 mm -80.73 151.04 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.839 178.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.56 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.91 172.23 12.97 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.107 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.57 HD22 ' HA2' ' A' ' 46' ' ' GLY . 23.5 t-20 -112.18 108.85 18.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.682 -179.413 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 50.8 mm -109.64 89.78 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.315 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 43.9 t0 66.21 38.05 4.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.332 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.57 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 85.25 0.63 88.55 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.182 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.4 m -112.08 137.36 50.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.924 0.393 . . . . 0.0 111.003 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 26.8 mt -76.95 117.5 18.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.705 0.764 . . . . 0.0 111.565 -177.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -138.44 162.86 33.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.836 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.803 ' CH2' HD11 ' A' ' 85' ' ' ILE . 4.0 m-90 -84.86 123.13 30.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.039 0.447 . . . . 0.0 111.865 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.56 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -172.17 147.17 1.8 Allowed Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.255 -179.739 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.419 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 51.6 Cg_endo -69.65 63.7 1.73 Allowed 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.231 1.954 . . . . 0.0 112.305 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.402 ' O ' ' O ' ' A' ' 41' ' ' ILE . 3.1 p -158.28 135.15 9.79 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.32 179.111 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.01 109.71 15.86 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.517 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.461 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 37.6 p90 -48.92 -29.4 4.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.466 178.28 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.3 p -48.31 -17.89 0.18 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.883 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -63.75 -29.01 70.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.623 0.249 . . . . 0.0 111.39 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.2 p -127.51 -0.94 6.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.473 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.7 m -110.53 147.97 33.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.202 0.525 . . . . 0.0 111.931 -178.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.7 p90 -142.29 157.61 44.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.045 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.6 m120 64.14 47.29 3.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.947 0.403 . . . . 0.0 110.856 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.747 ' O ' HD22 ' A' ' 13' ' ' LEU . 6.1 m -70.79 135.03 47.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.689 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.12 150.36 42.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.575 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.497 HG13 ' HB2' ' A' ' 13' ' ' LEU . 33.6 mt -128.68 138.76 53.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.376 0.608 . . . . 0.0 111.891 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -136.09 108.19 7.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.16 -0.927 . . . . 0.0 108.963 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.441 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 69.53 -121.36 11.01 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.442 -0.885 . . . . 0.0 111.449 -178.638 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.45 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.2 p -101.68 -4.17 26.98 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.52 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.2 t -101.41 140.37 20.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.033 0.444 . . . . 0.0 111.99 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.897 HD22 HD22 ' A' ' 37' ' ' LEU . 7.7 tp -102.49 125.97 49.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.349 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.504 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -116.11 124.69 51.0 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.5 t -151.79 153.77 34.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.704 0.287 . . . . 0.0 111.485 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 18.8 m -94.83 126.22 40.01 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 178.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.548 ' HB3' HD22 ' A' ' 43' ' ' ASN . 88.1 m -125.95 144.98 50.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.351 0.596 . . . . 0.0 112.37 -178.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -74.26 137.43 42.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.914 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -91.93 142.5 27.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.665 0.269 . . . . 0.0 110.446 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 56.4 m -52.14 -26.8 12.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.539 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -83.43 2.03 38.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.579 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.45 134.99 6.87 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.774 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.09 -169.14 12.76 Favored Glycine 0 C--N 1.319 -0.41 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -131.04 143.31 50.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 117.337 0.568 . . . . 0.0 111.308 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -153.9 128.85 9.53 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.167 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.7 t -91.97 134.71 34.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.495 -179.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 21.8 p -121.96 158.03 29.97 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.276 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.6 p -123.2 145.02 48.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.878 0.371 . . . . 0.0 110.978 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.803 HD11 ' CH2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -146.99 145.03 19.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.628 -179.822 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.776 ' N ' HD13 ' A' ' 85' ' ' ILE . 46.1 t0 -98.56 117.91 34.07 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.244 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.603 HD22 HD11 ' A' ' 41' ' ' ILE . 6.3 mt -100.1 -6.47 26.26 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.242 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.792 ' OD1' HG22 ' A' ' 5' ' ' ILE . 36.5 t30 -45.01 -27.04 0.5 Allowed 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -178.392 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.7 m -80.26 -38.34 31.11 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.669 HG11 ' CZ2' ' A' ' 50' ' ' TRP . 3.2 m -75.49 -51.83 19.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -178.479 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.531 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -81.57 147.49 6.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.034 0.445 . . . . 0.0 111.247 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.44 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 23.1 tt0 -139.08 167.0 23.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.266 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -106.26 99.56 9.14 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.18 0.514 . . . . 0.0 110.378 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.404 ' CG2' ' HG3' ' A' ' 99' ' ' LYS . 58.6 t -97.95 96.51 5.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.999 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.413 ' O ' HG22 ' A' ' 25' ' ' THR . 28.5 t0 53.45 32.84 14.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.632 0.253 . . . . 0.0 111.515 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.44 28.38 11.59 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.831 -0.7 . . . . 0.0 113.345 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.7 m -141.1 135.06 30.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 0.0 111.009 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.484 HD21 ' SG ' ' A' ' 23' ' ' CYS . 54.1 mt -73.39 119.94 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.759 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.3 mttm -123.81 133.95 53.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.467 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.404 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 36.6 t80 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.34 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.46 ' CE2' ' HA ' ' A' ' 88' ' ' ASN . 22.8 p90 . . . . . 0 N--CA 1.466 0.333 0 N-CA-C 111.617 0.229 . . . . 0.0 111.617 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.811 HG22 ' OD1' ' A' ' 88' ' ' ASN . 3.8 tp -64.43 -18.16 22.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.674 0.274 . . . . 0.0 111.272 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.31 -24.19 60.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.873 0.368 . . . . 0.0 110.577 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.4 p -118.46 -3.77 10.9 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.682 179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.8 m -108.19 152.58 24.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.966 0.412 . . . . 0.0 111.482 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -132.09 172.42 12.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.751 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.403 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 6.2 p-10 48.43 58.05 5.6 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.799 HG21 ' CD1' ' A' ' 5' ' ' ILE . 66.9 p -79.67 132.75 36.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.319 178.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.629 ' O ' HD12 ' A' ' 19' ' ' LEU . 19.6 pt20 -158.71 163.95 36.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.192 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.692 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.42 136.38 37.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.147 0.499 . . . . 0.0 110.863 -179.666 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.22 143.81 47.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.098 179.237 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.29 -152.78 32.9 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 119.89 -1.147 . . . . 0.0 111.462 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -85.83 -37.09 19.59 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.458 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -141.43 36.23 1.67 Allowed 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 8.2 mp0 -115.83 146.67 41.78 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.808 0.337 . . . . 0.0 111.81 178.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.764 ' CB ' HD11 ' A' ' 37' ' ' LEU . 10.7 tp -119.86 124.76 46.86 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.21 142.66 47.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.2 172.72 16.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.189 -178.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -115.45 133.54 55.93 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 177.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.7 m -130.77 135.66 47.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.077 0.465 . . . . 0.0 111.62 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.7 ptpt -66.88 136.93 56.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.675 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.637 HG22 ' O ' ' A' ' 95' ' ' ASP . 42.4 p -84.91 -176.92 6.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.696 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.8 mmt-85 -61.48 -30.48 70.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.801 0.334 . . . . 0.0 110.995 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.12 9.17 9.05 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 66.99 38.81 3.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.317 0.579 . . . . 0.0 111.099 -178.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.434 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 60.8 mt-30 -119.42 134.89 54.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.283 -0.872 . . . . 0.0 108.872 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.406 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 43.4 m-85 -93.09 124.65 37.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.972 0.415 . . . . 0.0 111.544 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.1 m -130.36 153.58 39.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.811 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.24 134.46 44.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.27 0.557 . . . . 0.0 112.186 -178.478 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.8 t -143.59 161.21 39.08 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.28 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.0 ttmt -142.86 156.73 44.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.341 0.591 . . . . 0.0 111.887 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.482 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.03 128.05 49.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.017 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -88.33 115.42 25.82 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.626 0.25 . . . . 0.0 111.296 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.967 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -86.59 -15.44 39.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.344 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.422 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -57.09 -45.22 83.53 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 -178.757 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -91.89 -10.41 39.73 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.494 ' CD2' ' CD2' ' A' ' 100' ' ' TYR . 8.9 m80 -98.33 -63.33 1.14 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.533 HD13 ' CD1' ' A' ' 50' ' ' TRP . 20.6 mm -80.6 147.73 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.952 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.07 172.24 12.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.526 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.619 HD22 ' HA2' ' A' ' 46' ' ' GLY . 26.6 t-20 -113.11 111.72 22.61 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.164 -179.189 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.78 HD13 ' HB2' ' A' ' 49' ' ' LYS . 3.0 mp -112.01 89.34 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.909 0.385 . . . . 0.0 111.032 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.7 t0 67.78 38.26 2.97 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.258 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.619 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 85.75 0.88 87.57 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.564 -0.827 . . . . 0.0 113.424 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.4 m -110.72 135.41 51.36 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.307 0.554 . . . . 0.0 110.893 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.7 mt -77.63 118.76 20.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.454 0.645 . . . . 0.0 111.249 -178.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.78 ' HB2' HD13 ' A' ' 44' ' ' ILE . 28.2 mttt -138.99 163.24 32.89 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.514 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.727 ' CE2' HG11 ' A' ' 90' ' ' VAL . 7.7 m-90 -85.89 118.68 25.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.133 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.44 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 43.0 tt0 -174.66 143.14 0.8 Allowed Pre-proline 0 N--CA 1.465 0.31 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.005 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.403 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 28.4 Cg_endo -64.55 74.67 0.2 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.093 1.862 . . . . 0.0 113.164 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -165.75 135.19 3.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.348 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.464 ' N ' ' OD1' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.69 109.31 15.98 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -177.688 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 38.6 p90 -50.0 -28.41 6.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.808 178.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.1 p -49.32 -16.99 0.21 Allowed 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -63.92 -29.62 70.78 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 122.16 -0.338 . . . . 0.0 111.351 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.2 p -128.2 1.04 5.8 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.073 -0.251 . . . . 0.0 111.479 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.4 m -111.81 147.66 35.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.231 0.538 . . . . 0.0 112.095 -178.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -143.63 157.72 44.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.886 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 4.5 m120 64.15 46.33 3.69 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.029 0.442 . . . . 0.0 110.89 -179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.692 ' O ' HD22 ' A' ' 13' ' ' LEU . 35.8 m -70.53 137.6 50.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.097 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.66 151.67 41.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.986 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.477 HG21 HD13 ' A' ' 19' ' ' LEU . 54.4 mt -130.66 138.77 52.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 121.325 0.583 . . . . 0.0 111.889 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -136.03 111.26 9.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.273 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.484 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.82 -121.1 13.65 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.122 -1.037 . . . . 0.0 110.734 -178.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.418 ' HB3' ' HB ' ' A' ' 5' ' ' ILE . 22.5 p -103.07 -3.21 26.25 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.471 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.6 t -100.97 138.19 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 121.028 0.442 . . . . 0.0 111.937 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.967 HD22 HD22 ' A' ' 37' ' ' LEU . 6.8 tp -102.49 124.37 47.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.142 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.465 ' N ' HD12 ' A' ' 69' ' ' LEU . 4.5 m -115.67 126.92 54.75 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 t -152.01 153.86 34.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.768 0.318 . . . . 0.0 111.455 -179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.2 m -93.9 126.13 38.92 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.497 ' HB3' HD22 ' A' ' 43' ' ' ASN . 74.0 m -126.88 144.93 50.84 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.467 0.651 . . . . 0.0 112.508 -178.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -74.64 137.32 42.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.605 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -90.73 144.72 25.44 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.7 m -51.46 -26.46 8.23 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -83.17 3.07 32.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.634 0.254 . . . . 0.0 111.489 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.32 138.47 7.34 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.089 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.77 -169.83 13.09 Favored Glycine 0 C--N 1.318 -0.448 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -129.5 140.42 51.27 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 117.196 0.498 . . . . 0.0 111.066 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -154.01 128.93 9.49 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.406 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.6 t -93.41 134.87 35.2 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.916 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 37.6 p -121.98 158.3 29.41 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.516 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -122.12 144.52 48.89 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.662 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.653 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.6 tt -145.67 142.58 21.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.605 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -97.38 121.11 38.91 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.078 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.564 ' HB3' HD12 ' A' ' 91' ' ' ILE . 10.2 mt -100.58 -4.16 29.1 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.811 ' OD1' HG22 ' A' ' 5' ' ' ILE . 55.7 t30 -44.75 -28.44 0.63 Allowed 'General case' 0 N--CA 1.468 0.436 0 O-C-N 122.097 -0.377 . . . . 0.0 111.756 -178.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 49.1 m -81.64 -41.78 20.95 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.727 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.3 m -72.13 -52.75 22.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -177.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.564 HD12 ' HB3' ' A' ' 87' ' ' LEU . 2.6 mp -81.99 145.49 8.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.108 0.48 . . . . 0.0 111.47 -178.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.4 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 9.1 tt0 -135.96 166.25 23.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.062 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -107.95 99.53 8.98 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.27 0.557 . . . . 0.0 110.169 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.2 t -97.63 96.68 5.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.693 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.637 ' O ' HG22 ' A' ' 25' ' ' THR . 22.1 t0 53.42 33.18 15.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.613 0.244 . . . . 0.0 111.599 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.12 28.52 11.67 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.508 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.2 t -140.55 135.33 31.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.901 0.351 . . . . 0.0 110.875 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.429 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 55.6 mt -74.27 120.47 19.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.869 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -127.01 138.09 53.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.892 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.494 ' CD2' ' CD2' ' A' ' 40' ' ' HIS . 15.0 t80 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.845 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.448 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 17.0 p90 . . . . . 0 N--CA 1.464 0.262 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.802 HG22 ' OD1' ' A' ' 88' ' ' ASN . 6.8 tp -61.83 -22.56 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-O 120.679 0.276 . . . . 0.0 111.498 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -75.24 -24.53 57.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.069 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.8 p -118.05 -3.69 11.09 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 58.2 m -111.14 155.17 23.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.882 0.373 . . . . 0.0 111.069 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -130.22 172.43 11.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.79 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 48.08 59.52 4.19 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.763 HG21 ' CD1' ' A' ' 5' ' ' ILE . 16.6 p -78.78 132.21 36.82 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.766 ' O ' HD12 ' A' ' 19' ' ' LEU . 18.4 pt20 -157.43 163.62 38.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.938 0.399 . . . . 0.0 111.79 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.743 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.47 136.49 37.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.706 179.601 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.86 146.48 46.53 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.223 179.11 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.64 -153.15 25.12 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 119.771 -1.204 . . . . 0.0 111.365 -178.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.7 m -85.52 -36.95 20.18 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -140.81 36.11 1.79 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 5.0 mp0 -115.23 149.64 37.41 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.153 0.501 . . . . 0.0 112.172 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.801 ' CB ' HD11 ' A' ' 37' ' ' LEU . 19.4 tp -122.45 123.06 40.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.239 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.461 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . . . -119.02 143.98 46.79 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.47 172.82 15.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.302 -178.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -110.98 133.99 52.95 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 61.4 m -130.8 132.08 45.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.052 0.453 . . . . 0.0 111.92 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.11 137.0 56.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.411 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.421 HG22 ' O ' ' A' ' 95' ' ' ASP . 53.3 p -87.3 -177.74 6.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.516 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.9 mmt85 -62.2 -28.94 70.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.557 0.218 . . . . 0.0 111.288 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.36 8.39 9.34 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 66.66 38.0 4.15 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.263 0.554 . . . . 0.0 110.653 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -118.88 136.08 54.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.977 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -92.69 124.74 36.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.931 0.396 . . . . 0.0 111.452 -178.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.2 m -129.81 148.67 33.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.417 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.5 t -71.61 137.15 47.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.179 0.514 . . . . 0.0 111.946 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 t -145.97 162.35 38.01 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.643 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.461 ' HG3' ' HB2' ' A' ' 20' ' ' ALA . 28.8 ttpt -143.88 155.84 44.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.316 0.579 . . . . 0.0 112.043 -179.028 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.463 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.26 127.77 47.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -89.1 118.6 28.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.72 0.295 . . . . 0.0 110.863 -177.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.801 HD11 ' CB ' ' A' ' 19' ' ' LEU . 3.7 mp -88.96 -16.11 32.57 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.852 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.401 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.1 p-10 -56.57 -43.93 80.47 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -178.372 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.401 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.3 OUTLIER -92.71 -10.59 36.58 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 122.201 -0.312 . . . . 0.0 111.601 178.92 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -96.65 -64.92 1.0 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.626 HD11 HD22 ' A' ' 87' ' ' LEU . 23.2 mm -80.93 148.49 5.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.734 178.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -138.52 172.26 13.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.84 -179.626 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.412 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 30.0 t30 -111.96 109.59 19.45 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.464 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 37.8 mm -109.54 88.98 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.678 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 49.8 t0 67.17 39.68 3.03 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.255 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.48 0.75 88.11 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.829 -0.7 . . . . 0.0 113.439 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 39.1 m -113.78 138.23 50.54 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.033 0.444 . . . . 0.0 111.429 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.6 mt -77.17 117.17 18.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.645 0.736 . . . . 0.0 111.118 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 46.4 mttt -135.84 162.49 32.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.859 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.825 ' CH2' HD11 ' A' ' 85' ' ' ILE . 4.9 m-90 -85.33 118.04 24.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.966 0.412 . . . . 0.0 111.149 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.417 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 29.2 tt0 -173.04 142.25 1.02 Allowed Pre-proline 0 N--CA 1.465 0.324 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.705 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.4 ' HD2' ' HG3' ' A' ' 51' ' ' GLN . 34.3 Cg_endo -64.97 73.29 0.23 Allowed 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 121.968 1.779 . . . . 0.0 112.455 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.408 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -162.85 134.57 5.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.69 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.23 109.34 16.42 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.149 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.412 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 29.8 p90 -48.5 -30.74 5.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.876 178.477 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.2 p -49.14 -17.82 0.26 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -178.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -62.02 -28.66 69.74 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.136 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.412 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.5 p -128.56 -0.09 5.55 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.387 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.2 m -110.69 148.8 31.52 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -141.1 156.97 45.9 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.248 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 62.96 46.53 4.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.98 0.419 . . . . 0.0 110.632 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.743 ' O ' HD22 ' A' ' 13' ' ' LEU . 73.0 m -69.31 135.96 51.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.188 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.403 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -143.16 152.57 41.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.673 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.52 HD13 HD13 ' A' ' 19' ' ' LEU . 52.4 mt -129.83 140.1 49.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.284 0.564 . . . . 0.0 111.905 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -135.23 108.83 7.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.257 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.449 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.18 -120.95 14.55 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.445 -0.883 . . . . 0.0 111.012 -178.435 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.455 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.5 p -100.85 -3.17 30.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.144 0.472 . . . . 0.0 111.858 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.568 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.3 t -101.95 138.51 25.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-O 121.01 0.433 . . . . 0.0 111.922 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.784 HD22 HD22 ' A' ' 37' ' ' LEU . 6.6 tp -101.13 124.92 47.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.394 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.462 ' N ' HD12 ' A' ' 69' ' ' LEU . 2.9 m -115.16 125.12 53.05 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.2 t -151.94 154.09 35.38 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.616 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.9 m -93.88 125.81 38.72 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 84.8 m -127.95 145.3 51.01 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 -178.37 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -75.63 136.47 40.46 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.585 178.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -92.21 146.01 24.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.669 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.3 m -51.79 -27.38 12.12 Favored 'General case' 0 N--CA 1.462 0.155 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -82.95 2.3 35.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.524 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.95 137.79 6.83 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.417 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.19 -169.46 12.89 Favored Glycine 0 C--N 1.319 -0.396 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -178.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -132.03 142.18 49.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.282 0.541 . . . . 0.0 111.15 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -154.32 128.28 8.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.124 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.0 OUTLIER -91.61 134.16 34.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.264 -179.479 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 p -119.29 158.27 26.39 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.588 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 4.4 p -120.15 142.75 48.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.818 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.841 HD13 ' N ' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -148.07 144.95 18.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.529 179.736 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.841 ' N ' HD13 ' A' ' 85' ' ' ILE . 11.0 t70 -100.79 120.73 40.54 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.585 -179.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.626 HD22 HD11 ' A' ' 41' ' ' ILE . 12.1 mt -102.02 -3.25 27.98 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.802 ' OD1' HG22 ' A' ' 5' ' ' ILE . 41.7 t30 -45.0 -26.96 0.49 Allowed 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.2 m -80.22 -42.17 23.79 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.684 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.7 m -71.63 -52.9 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -178.126 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.653 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.2 mp -80.53 147.68 6.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.945 0.402 . . . . 0.0 111.342 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.413 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 12.9 tt0 -139.46 167.2 22.63 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.473 -178.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -105.8 99.5 9.1 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.997 0.427 . . . . 0.0 110.639 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.2 t -100.34 94.87 3.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.787 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.421 ' O ' HG22 ' A' ' 25' ' ' THR . 20.5 t0 55.36 32.58 19.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.674 0.273 . . . . 0.0 111.448 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.28 27.87 14.57 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.915 -0.659 . . . . 0.0 113.204 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.3 t -139.05 134.02 32.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.73 0.3 . . . . 0.0 111.059 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.425 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 78.2 mt -72.74 118.78 16.09 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.945 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -124.74 140.5 52.88 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 32.5 t80 . . . . . 0 C--N 1.332 -0.182 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.014 178.998 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.44 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 18.3 p90 . . . . . 0 N--CA 1.464 0.251 0 CA-C-O 120.702 0.287 . . . . 0.0 111.349 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.802 HG22 ' OD1' ' A' ' 88' ' ' ASN . 6.7 tp -66.24 -13.18 15.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -77.54 -26.82 51.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.891 0.377 . . . . 0.0 110.878 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.2 p -118.56 0.34 11.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.528 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 76.0 m -112.31 153.44 27.21 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 121.015 0.436 . . . . 0.0 111.047 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.8 ptt180 -132.57 172.6 12.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.989 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 48.91 58.0 5.82 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.655 HG21 ' CD1' ' A' ' 5' ' ' ILE . 8.4 p -79.32 131.64 36.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.979 178.598 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.753 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.8 pt20 -155.97 163.01 40.27 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.4 -179.542 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.751 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.42 135.79 38.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.546 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.86 144.34 47.43 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.272 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.38 -151.71 31.34 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 119.799 -1.191 . . . . 0.0 111.3 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.65 -37.06 18.38 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -140.54 35.44 1.83 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.4 mp0 -115.15 146.89 40.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.059 0.457 . . . . 0.0 111.781 179.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.808 ' CB ' HD11 ' A' ' 37' ' ' LEU . 14.6 tp -122.04 124.25 43.52 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.014 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.81 144.07 46.54 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.935 0.398 . . . . 0.0 110.141 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.31 172.35 16.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.17 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -114.57 134.05 55.34 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 177.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.431 ' SG ' HD21 ' A' ' 98' ' ' LEU . 55.7 m -130.57 134.15 46.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.281 0.563 . . . . 0.0 111.894 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.2 ptpt -66.04 137.48 57.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.423 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.635 HG22 ' O ' ' A' ' 95' ' ' ASP . 66.0 p -85.9 -176.43 5.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.644 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -62.93 -30.56 71.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.231 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.81 9.68 7.61 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 66.88 37.67 3.94 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.132 0.492 . . . . 0.0 111.425 -178.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.442 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 54.4 mt-30 -117.25 137.69 52.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.009 177.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -94.85 125.06 39.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.859 0.361 . . . . 0.0 111.849 -178.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 m -131.04 151.05 35.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.0 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.7 p -71.92 135.8 46.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.246 0.546 . . . . 0.0 111.876 -178.816 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.4 t -143.26 161.42 38.33 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.214 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.4 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 13.4 ttmt -142.2 156.1 45.31 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.411 0.624 . . . . 0.0 111.933 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.422 HG23 ' O ' ' A' ' 35' ' ' ILE . 1.3 tp -138.42 125.0 26.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.115 -0.948 . . . . 0.0 108.818 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -86.8 119.13 26.7 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.677 0.275 . . . . 0.0 111.153 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.856 HD22 HD22 ' A' ' 69' ' ' LEU . 4.4 mp -87.99 -16.0 34.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.634 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.444 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -57.69 -44.81 86.11 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.076 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.444 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.4 OUTLIER -91.76 -10.4 40.11 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 122.106 -0.371 . . . . 0.0 111.061 179.285 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.438 ' HB3' HD12 ' A' ' 41' ' ' ILE . 23.6 m-70 -97.87 -68.43 0.8 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.623 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.7 mp -78.59 150.67 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.287 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.439 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.09 172.58 12.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.953 -179.259 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.646 HD22 ' HA2' ' A' ' 46' ' ' GLY . 20.7 t-20 -111.34 109.45 19.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.083 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 33.3 mm -109.88 89.69 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.407 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 55.6 t0 68.0 38.78 2.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.259 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.646 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 84.16 0.7 89.61 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.824 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.9 m -112.81 136.94 51.85 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.863 0.363 . . . . 0.0 110.882 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.415 HD22 HG21 ' A' ' 41' ' ' ILE . 13.5 mt -77.41 117.39 18.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.638 0.733 . . . . 0.0 111.281 -178.098 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.1 mttm -137.51 162.7 33.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.721 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.757 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.2 m-90 -87.27 121.89 30.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.087 0.47 . . . . 0.0 111.561 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 53' ' ' SER . 3.2 tp60 -175.06 143.39 0.76 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.873 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.402 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 23.4 Cg_endo -62.41 69.43 0.12 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.208 1.939 . . . . 0.0 112.553 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -160.49 134.75 7.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.834 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.431 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -82.49 108.42 15.88 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.158 0.504 . . . . 0.0 112.027 -178.068 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.44 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 33.4 p90 -47.63 -31.33 4.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.301 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 45.8 p -47.78 -16.25 0.07 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.316 -0.857 . . . . 0.0 113.006 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -64.56 -26.83 68.59 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.559 0.219 . . . . 0.0 111.381 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.0 p -134.01 5.41 3.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.322 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.6 m -115.18 148.98 38.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.228 0.537 . . . . 0.0 111.837 -178.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -142.84 157.63 44.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.968 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.4 m-20 63.34 46.07 4.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.981 0.42 . . . . 0.0 110.954 -179.469 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.751 ' O ' HD22 ' A' ' 13' ' ' LEU . 43.2 m -69.59 136.02 50.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.496 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.33 151.03 43.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.511 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.514 HG13 ' HB2' ' A' ' 13' ' ' LEU . 52.2 mt -129.81 140.89 47.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.225 0.536 . . . . 0.0 111.728 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -138.13 110.4 7.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.01 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.36 -122.28 14.77 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.269 -0.967 . . . . 0.0 111.101 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.436 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.3 p -101.32 -2.37 31.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.5 t -102.63 138.62 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.012 0.434 . . . . 0.0 112.109 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.856 HD22 HD22 ' A' ' 37' ' ' LEU . 8.7 tp -102.53 126.93 49.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.329 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.446 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -117.56 125.95 51.72 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.4 t -151.83 153.43 34.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.607 0.241 . . . . 0.0 111.16 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 18.5 m -94.2 126.02 39.18 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.527 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 85.4 m -126.45 145.15 50.6 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.281 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -74.51 136.52 42.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.772 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.1 mtm180 -91.72 143.61 26.37 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 69.2 m -51.83 -27.23 11.82 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -83.67 2.28 38.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.65 0.262 . . . . 0.0 111.531 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.81 136.95 7.4 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.911 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.96 -169.73 13.07 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 111.101 -0.8 . . . . 0.0 111.101 -178.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -130.8 142.04 50.38 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 117.304 0.552 . . . . 0.0 111.22 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -154.15 129.13 9.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.517 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -92.75 134.33 35.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.271 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.3 p -122.77 158.18 30.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.377 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 57.8 p -121.01 144.88 48.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.906 0.384 . . . . 0.0 111.059 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.628 HD11 ' CH2' ' A' ' 50' ' ' TRP . 13.5 tt -144.21 143.0 23.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.399 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -96.88 115.86 28.17 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.995 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.605 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 16.1 mt -95.91 -7.19 37.38 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.802 ' OD1' HG22 ' A' ' 5' ' ' ILE . 53.8 t30 -44.7 -27.83 0.54 Allowed 'General case' 0 N--CA 1.467 0.392 0 O-C-N 122.178 -0.326 . . . . 0.0 111.869 -178.583 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.88 -37.88 26.22 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.757 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -74.36 -53.87 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 -178.181 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.552 HD12 ' HB3' ' A' ' 87' ' ' LEU . 3.0 mp -80.95 147.78 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.05 0.452 . . . . 0.0 111.465 -178.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.424 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 14.4 tt0 -138.07 164.45 29.08 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.852 -178.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 20.8 t30 -106.67 99.72 9.28 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.087 0.47 . . . . 0.0 110.528 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.453 ' HB ' ' CE ' ' A' ' 99' ' ' LYS . 39.1 t -99.86 96.65 5.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.187 179.387 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.635 ' O ' HG22 ' A' ' 25' ' ' THR . 19.2 t0 53.62 33.0 15.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.66 28.79 13.23 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.697 -0.763 . . . . 0.0 113.054 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -141.91 134.33 28.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.746 0.308 . . . . 0.0 110.925 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.431 HD21 ' SG ' ' A' ' 23' ' ' CYS . 49.8 mt -75.06 119.14 18.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.12 0.486 . . . . 0.0 111.51 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.453 ' CE ' ' HB ' ' A' ' 94' ' ' VAL . 0.9 OUTLIER -122.85 153.41 39.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.084 179.589 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 53.9 t80 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.928 -179.792 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.443 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 19.6 p90 . . . . . 0 N--CA 1.465 0.284 0 CA-C-O 120.645 0.26 . . . . 0.0 111.543 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.779 HG22 ' OD1' ' A' ' 88' ' ' ASN . 7.8 tp -63.02 -19.84 24.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.673 0.273 . . . . 0.0 111.393 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.506 ' OE2' HG23 ' A' ' 5' ' ' ILE . 38.2 mm-40 -78.48 -26.37 46.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.766 0.317 . . . . 0.0 110.726 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.6 p -118.32 13.83 13.71 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.984 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.9 m -129.77 156.2 44.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.933 0.397 . . . . 0.0 111.167 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.34 172.5 12.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.034 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 47.98 58.56 4.95 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.771 HG21 ' CD1' ' A' ' 5' ' ' ILE . 30.0 p -79.06 132.79 36.73 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.44 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.655 ' O ' HD12 ' A' ' 19' ' ' LEU . 3.7 pt20 -157.36 163.81 38.22 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.973 0.416 . . . . 0.0 111.453 -179.154 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.769 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.49 136.1 38.4 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.035 -179.835 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.444 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -118.6 143.45 46.79 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.04 -150.75 31.93 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 119.877 -1.154 . . . . 0.0 111.712 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -87.21 -36.62 17.87 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -178.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.425 ' OG ' ' HB3' ' A' ' 38' ' ' ASP . 3.1 p -140.69 35.07 1.8 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 3.0 mp0 -115.45 148.02 39.9 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.205 0.526 . . . . 0.0 112.123 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.816 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.8 tp -122.06 123.83 42.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.319 179.199 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.29 143.61 47.25 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.19 172.33 16.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.081 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -111.27 133.56 53.51 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 86.1 m -131.01 134.2 46.47 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.416 -0.514 . . . . 0.0 112.277 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 5.3 ptpt -67.11 137.42 56.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.728 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.59 HG22 ' O ' ' A' ' 95' ' ' ASP . 36.2 p -86.05 -178.96 6.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.602 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -61.41 -29.13 69.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.709 0.29 . . . . 0.0 111.222 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.16 10.41 8.35 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 66.51 36.33 5.07 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.138 0.494 . . . . 0.0 111.345 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.414 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 4.3 mt-30 -116.42 137.61 52.02 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -93.92 125.3 38.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.945 0.402 . . . . 0.0 111.864 -178.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.4 m -131.0 150.74 34.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.696 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -72.53 135.96 45.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.145 0.498 . . . . 0.0 111.968 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.6 t -143.7 161.38 38.73 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.208 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -141.93 157.24 45.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.509 0.671 . . . . 0.0 112.283 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.535 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.3 tp -138.47 125.79 27.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.076 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -87.88 119.13 27.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.664 0.268 . . . . 0.0 110.998 -178.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.863 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -88.31 -14.54 38.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.5 p-10 -58.49 -43.46 89.02 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.19 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.455 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.9 OUTLIER -92.16 -10.94 36.97 Favored 'General case' 0 N--CA 1.465 0.306 0 O-C-N 122.096 -0.377 . . . . 0.0 111.8 179.568 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.451 ' CE1' ' CD2' ' A' ' 100' ' ' TYR . 38.9 m-70 -97.8 -59.77 1.7 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.628 HD11 HD22 ' A' ' 87' ' ' LEU . 32.5 mm -81.28 146.16 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.575 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.494 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -139.02 170.34 16.16 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.298 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.449 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 29.8 t30 -112.95 109.68 19.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.53 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.2 mm -110.02 89.6 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.069 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.4 t0 68.52 39.43 2.13 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.089 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.28 5.57 89.5 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.864 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 m -115.23 136.42 53.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.793 0.33 . . . . 0.0 110.821 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.585 HD22 HG21 ' A' ' 41' ' ' ILE . 27.8 mt -77.53 116.15 17.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.666 0.746 . . . . 0.0 111.333 -178.312 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 mmtt -136.34 162.63 32.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.192 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.72 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 7.7 m-90 -86.07 123.47 31.41 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.323 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.494 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 2.8 mt-30 -172.03 152.6 2.95 Favored Pre-proline 0 N--CA 1.465 0.323 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.773 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.06 63.26 4.14 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.023 1.815 . . . . 0.0 112.359 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 4.4 p -155.92 135.03 12.11 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.506 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.43 ' ND2' ' N ' ' A' ' 54' ' ' ASN . 0.2 OUTLIER -81.22 109.56 15.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.182 0.515 . . . . 0.0 112.259 -177.956 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -47.3 -30.59 3.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.708 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 81.9 p -48.58 -18.12 0.22 Allowed 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -61.21 -28.07 68.89 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.933 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.449 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 6.1 p -130.7 1.34 4.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.3 m -111.47 149.18 31.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.192 0.52 . . . . 0.0 112.336 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.6 p90 -141.55 156.56 45.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.817 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 63.98 47.22 3.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.884 0.373 . . . . 0.0 111.242 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.769 ' O ' HD22 ' A' ' 13' ' ' LEU . 73.4 m -69.92 134.89 48.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.453 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.72 152.14 43.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.599 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.459 HG13 ' HB2' ' A' ' 13' ' ' LEU . 39.5 mt -128.92 138.06 55.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.4 0.619 . . . . 0.0 112.034 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -133.77 106.46 7.35 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.079 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.31 -121.89 11.96 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.49 -0.862 . . . . 0.0 111.58 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.429 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 24.3 p -99.41 -4.4 31.61 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.458 HG13 ' O ' ' A' ' 85' ' ' ILE . 3.5 t -102.04 140.51 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 121.109 0.48 . . . . 0.0 112.191 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.863 HD22 HD22 ' A' ' 37' ' ' LEU . 9.3 tp -102.55 126.12 49.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.085 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.418 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.0 m -116.0 125.29 52.3 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.218 -0.289 . . . . 0.0 110.218 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.6 t -152.02 153.59 34.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.612 0.244 . . . . 0.0 111.353 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 22.1 m -95.05 126.44 40.39 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 76.6 m -126.02 145.06 50.47 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -74.5 136.58 42.21 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.848 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -93.2 144.37 25.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.691 0.282 . . . . 0.0 111.119 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.3 m -52.02 -28.83 18.49 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.635 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -82.61 1.7 36.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.638 0.256 . . . . 0.0 111.479 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.07 136.15 7.19 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.707 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.5 -170.91 13.47 Favored Glycine 0 C--N 1.319 -0.392 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 -178.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -129.54 143.12 50.69 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 117.286 0.543 . . . . 0.0 111.059 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -153.81 130.13 10.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.174 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.9 t -92.7 134.89 34.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.636 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 26.4 p -122.21 157.79 30.83 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.197 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.1 p -123.69 145.09 49.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.861 0.362 . . . . 0.0 111.086 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.72 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.3 tt -146.34 142.79 21.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.762 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -96.77 118.31 32.94 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.131 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.628 HD22 HD11 ' A' ' 41' ' ' ILE . 9.5 mt -97.4 -6.82 33.18 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.779 ' OD1' HG22 ' A' ' 5' ' ' ILE . 47.9 t30 -45.06 -28.7 0.74 Allowed 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -178.332 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.9 m -80.59 -40.67 25.34 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.685 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.7 m -72.8 -50.82 30.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 113.067 0.765 . . . . 0.0 113.067 -178.338 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.594 HD12 ' HB3' ' A' ' 87' ' ' LEU . 2.6 mp -82.93 147.35 5.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.137 0.494 . . . . 0.0 111.461 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 4.9 tt0 -138.96 166.83 23.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.96 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -108.02 99.91 9.3 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.059 0.457 . . . . 0.0 110.743 -179.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.43 HG21 ' HG3' ' A' ' 99' ' ' LYS . 48.2 t -99.17 96.88 5.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.848 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.59 ' O ' HG22 ' A' ' 25' ' ' THR . 30.0 t0 52.6 33.67 14.1 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.37 28.35 11.72 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.579 -0.82 . . . . 0.0 113.3 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -140.99 134.11 29.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.907 0.384 . . . . 0.0 111.2 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.414 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 59.3 mt -73.5 119.56 17.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.529 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.43 ' HG3' HG21 ' A' ' 94' ' ' VAL . 2.3 mmmt -125.18 141.75 51.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.194 0.521 . . . . 0.0 111.985 -179.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.451 ' CD2' ' CE1' ' A' ' 40' ' ' HIS . 46.1 t80 . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.659 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.464 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 31.0 p90 . . . . . 0 N--CA 1.464 0.253 0 CA-C-O 120.724 0.297 . . . . 0.0 111.127 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.804 HG22 ' OD1' ' A' ' 88' ' ' ASN . 6.8 tp -63.87 -17.63 20.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.736 0.303 . . . . 0.0 111.161 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.62 -26.47 54.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.959 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.0 p -118.67 18.59 13.4 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.183 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.3 m -134.41 154.91 51.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.968 0.413 . . . . 0.0 111.063 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.412 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 1.6 ptm180 -134.25 172.8 12.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.19 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.412 ' OD1' ' O ' ' A' ' 9' ' ' ARG . 6.3 p-10 49.04 57.4 6.5 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.3 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.614 HG21 ' CD1' ' A' ' 5' ' ' ILE . 4.2 p -79.58 134.14 36.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.88 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.758 ' O ' HD12 ' A' ' 19' ' ' LEU . 3.1 pt20 -158.35 163.66 37.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.388 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.761 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.31 135.85 38.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.156 0.503 . . . . 0.0 110.73 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.28 146.12 46.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.085 179.135 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.78 -153.33 25.31 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.814 -1.184 . . . . 0.0 111.408 -179.021 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.0 -36.85 19.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -141.04 36.23 1.74 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.9 OUTLIER -116.05 146.09 42.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.168 0.509 . . . . 0.0 111.881 179.172 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.758 HD12 ' O ' ' A' ' 12' ' ' GLN . 15.2 tp -120.89 125.07 46.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.175 178.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.6 143.93 47.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.858 0.361 . . . . 0.0 110.031 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.28 172.51 16.51 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.386 -178.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.15 133.54 54.23 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.312 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.2 m -130.77 132.82 45.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.158 0.504 . . . . 0.0 112.043 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.1 ptpt -66.52 135.73 54.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.105 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.0 p -85.89 -176.28 5.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.633 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.1 mtt-85 -61.46 -29.91 70.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.742 0.306 . . . . 0.0 111.257 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.76 8.86 9.0 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 66.53 37.06 4.69 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.169 0.509 . . . . 0.0 111.059 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.425 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.0 OUTLIER -118.24 136.33 53.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.995 178.103 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -92.64 125.47 37.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.921 0.391 . . . . 0.0 111.858 -178.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.1 m -129.87 152.56 37.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.828 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.4 t -72.75 133.54 44.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.178 0.513 . . . . 0.0 111.592 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -142.11 161.37 38.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.272 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -142.5 154.99 45.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.407 0.622 . . . . 0.0 112.206 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.573 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -136.41 124.87 36.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.821 179.18 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -88.64 120.29 29.9 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.683 0.278 . . . . 0.0 111.036 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.849 HD22 HD22 ' A' ' 69' ' ' LEU . 4.5 mp -88.05 -14.52 38.73 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.5 p-10 -57.49 -45.06 85.34 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -178.151 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.8 OUTLIER -92.3 -10.53 38.03 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 122.106 -0.371 . . . . 0.0 111.569 179.434 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -98.12 -65.56 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.604 HG13 HD23 ' A' ' 37' ' ' LEU . 15.7 mm -80.48 150.16 4.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.708 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.504 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.18 172.29 12.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.726 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.474 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 24.9 t30 -112.71 110.57 20.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.373 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.8 mm -110.86 89.62 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.042 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.4 t70 68.71 39.19 2.04 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.908 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.75 0.66 90.29 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.978 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.1 m -110.53 136.74 49.19 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.933 0.397 . . . . 0.0 110.858 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.9 mt -77.08 116.31 17.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.544 0.687 . . . . 0.0 111.012 -178.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 31.4 mttt -135.25 161.92 34.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.015 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.732 ' CE2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -86.58 119.15 26.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.938 0.399 . . . . 0.0 111.19 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.504 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 1.3 tp-100 -175.51 141.56 0.64 Allowed Pre-proline 0 C--N 1.331 -0.208 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.201 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.47 76.17 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.265 1.977 . . . . 0.0 112.781 -179.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -166.89 135.41 2.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.665 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.08 108.99 15.99 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.416 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 25.4 p90 -49.51 -31.0 9.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.761 178.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.1 p -48.9 -16.77 0.14 Allowed 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -179.122 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -63.27 -29.53 70.84 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.15 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.474 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -128.89 1.86 5.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.286 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.7 m -112.79 147.93 35.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.244 0.545 . . . . 0.0 111.864 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 26.6 p90 -143.21 157.74 44.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.929 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 63.32 44.24 5.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.006 0.432 . . . . 0.0 110.485 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.761 ' O ' HD22 ' A' ' 13' ' ' LEU . 20.5 m -69.08 137.14 53.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.466 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.405 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.87 152.89 42.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.596 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.488 ' CD1' HD13 ' A' ' 19' ' ' LEU . 33.8 mt -129.72 140.44 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-O 121.288 0.566 . . . . 0.0 111.805 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -136.19 108.55 7.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.791 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.411 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.93 -120.84 12.97 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.431 -0.89 . . . . 0.0 111.243 -178.51 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.402 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.9 p -101.72 -3.67 27.78 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -179.329 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.1 t -101.88 139.23 23.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.977 0.418 . . . . 0.0 111.756 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.849 HD22 HD22 ' A' ' 37' ' ' LEU . 10.6 tp -100.93 125.12 47.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.332 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.6 m -115.6 123.49 48.56 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.2 t -151.92 153.83 34.91 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.41 -178.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 6.3 m -94.18 125.78 39.02 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.688 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 88.0 m -126.01 143.95 50.9 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -74.13 136.84 42.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.753 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ARG . . . . . 0.414 ' HB3' ' NH1' ' A' ' 75' ' ' ARG . 12.5 mtp-105 -92.15 144.21 25.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.724 0.297 . . . . 0.0 110.503 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.2 m -52.06 -27.12 12.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.749 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -83.56 2.39 37.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.617 0.246 . . . . 0.0 111.651 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.73 136.26 7.07 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.687 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.62 -169.6 12.99 Favored Glycine 0 C--N 1.318 -0.434 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 -178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -130.0 142.05 50.67 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.266 0.533 . . . . 0.0 111.123 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -153.79 128.74 9.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.203 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.7 t -93.12 134.69 35.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.607 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.3 p -122.9 158.35 30.56 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.443 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 14.9 m -122.71 145.64 48.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.902 0.382 . . . . 0.0 111.201 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.717 HD11 ' CH2' ' A' ' 50' ' ' TRP . 9.9 tt -145.33 143.72 21.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.812 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -97.1 116.29 29.04 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.745 179.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.548 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 11.2 mt -97.62 -4.54 37.32 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.804 ' OD1' HG22 ' A' ' 5' ' ' ILE . 53.5 t30 -44.92 -27.72 0.57 Allowed 'General case' 0 N--CA 1.466 0.342 0 O-C-N 122.155 -0.341 . . . . 0.0 111.874 -178.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.5 -41.28 21.95 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.732 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.5 m -72.67 -52.33 23.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.118 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.653 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -83.13 147.37 5.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.103 0.477 . . . . 0.0 111.279 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 16.9 tt0 -139.92 167.09 22.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.14 -178.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -107.37 99.9 9.38 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.101 0.477 . . . . 0.0 110.805 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 58.8 t -98.53 97.48 6.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.007 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.7 t0 53.07 33.74 15.65 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.27 28.31 11.9 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.662 -0.78 . . . . 0.0 113.111 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.7 m -141.58 135.7 30.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.871 0.367 . . . . 0.0 111.279 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.482 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 63.0 mt -74.24 120.48 19.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.801 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.445 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 14.7 mttt -123.87 137.46 54.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.36 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.429 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 34.9 t80 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.791 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.2 p90 . . . . . 0 N--CA 1.463 0.199 0 CA-C-O 120.47 0.176 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.799 HG22 ' OD1' ' A' ' 88' ' ' ASN . 5.8 tp -67.7 -11.74 14.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.365 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -76.74 -26.08 54.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.834 0.35 . . . . 0.0 110.552 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.0 p -118.37 -3.35 10.97 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.447 179.23 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 70.6 m -108.11 150.6 26.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.126 0.488 . . . . 0.0 111.402 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.401 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.4 ptm180 -131.87 172.47 12.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.506 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.406 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.8 p-10 49.45 56.97 7.02 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.062 0.458 . . . . 0.0 111.685 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.707 HG21 ' CD1' ' A' ' 5' ' ' ILE . 8.3 p -79.32 132.59 36.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.691 178.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.726 ' O ' HD12 ' A' ' 19' ' ' LEU . 2.6 pt20 -158.14 163.89 37.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.44 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.72 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.31 136.38 37.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.028 -179.624 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.81 143.59 47.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.163 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.07 -152.27 33.03 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 119.78 -1.2 . . . . 0.0 111.324 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.23 -36.74 19.23 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.1 p -140.9 34.96 1.76 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -178.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -115.22 148.8 38.66 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.073 0.463 . . . . 0.0 111.662 178.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.766 ' CB ' HD11 ' A' ' 37' ' ' LEU . 12.6 tp -122.97 124.9 44.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.346 179.231 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.06 144.15 46.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.3 172.48 16.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.117 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -116.51 133.38 56.09 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 177.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.416 ' SG ' HD21 ' A' ' 98' ' ' LEU . 17.2 m -130.73 136.77 49.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.027 0.441 . . . . 0.0 111.893 -178.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.3 ptpt -66.74 137.9 56.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.481 -179.449 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.465 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.2 p -86.44 -175.78 5.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.879 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -61.64 -31.41 71.51 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 111.523 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.63 9.61 9.14 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 66.84 39.7 3.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.274 0.559 . . . . 0.0 111.381 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.43 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 74.8 mt-30 -118.82 136.65 53.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.664 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -93.77 124.82 38.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.898 0.38 . . . . 0.0 111.641 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.7 m -131.5 148.92 32.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.584 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 73.3 m -71.5 138.57 49.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.328 0.585 . . . . 0.0 112.044 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.6 t -143.94 161.25 39.19 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.18 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmmm? -139.87 154.61 47.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.396 0.617 . . . . 0.0 112.42 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.446 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.3 tp -137.78 125.08 29.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.048 -0.978 . . . . 0.0 108.925 179.037 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -88.97 120.61 30.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.728 0.299 . . . . 0.0 111.071 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.97 HD22 HD22 ' A' ' 69' ' ' LEU . 4.6 mp -88.98 -15.75 33.41 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.982 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.3 p-10 -57.82 -43.06 85.48 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -178.407 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.424 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 7.9 p-10 -92.77 -11.34 34.06 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 122.135 -0.353 . . . . 0.0 111.493 179.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.625 ' CD2' ' CD2' ' A' ' 100' ' ' TYR . 7.1 m80 -97.61 -65.95 0.93 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.616 HD12 ' N ' ' A' ' 41' ' ' ILE . 2.1 mp -80.77 148.78 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.172 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.3 170.84 14.96 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.116 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.538 ' C ' HD12 ' A' ' 44' ' ' ILE . 19.4 t30 -113.03 113.23 25.17 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.926 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.743 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.4 mp -113.16 89.44 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.028 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 69.62 36.83 2.05 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.006 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.81 1.31 85.25 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.695 -0.764 . . . . 0.0 113.467 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 18.1 m -111.69 135.81 51.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 117.252 0.526 . . . . 0.0 111.255 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.3 mt -77.59 116.92 18.54 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.648 0.737 . . . . 0.0 111.599 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.743 ' HB2' HD13 ' A' ' 44' ' ' ILE . 9.8 mttm -137.82 162.74 33.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.921 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.881 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 11.6 m-90 -87.02 121.8 29.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.882 0.372 . . . . 0.0 111.184 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.42 ' O ' ' N ' ' A' ' 53' ' ' SER . 35.2 tt0 -175.6 144.75 0.77 Allowed Pre-proline 0 N--CA 1.464 0.231 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.984 -179.595 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.424 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 29.9 Cg_endo -64.45 71.56 0.21 Allowed 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.084 1.856 . . . . 0.0 112.785 -179.103 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 51' ' ' GLN . 4.0 p -162.86 133.31 4.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.527 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -81.07 110.18 16.35 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -177.869 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.424 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 37.8 p90 -48.83 -29.38 4.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.402 178.257 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 74.8 p -48.65 -19.08 0.31 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.843 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -61.58 -30.49 70.71 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.34 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.426 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -127.96 -0.19 5.94 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.146 -0.222 . . . . 0.0 111.496 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -110.95 149.19 31.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.247 0.546 . . . . 0.0 112.292 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -143.02 157.43 44.55 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.102 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 64.03 46.52 3.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.003 0.43 . . . . 0.0 110.536 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.72 ' O ' HD22 ' A' ' 13' ' ' LEU . 26.9 m -69.51 136.7 51.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.71 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.451 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.27 151.56 42.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.686 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.53 HG21 HD13 ' A' ' 19' ' ' LEU . 37.5 mt -130.6 139.04 52.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.354 0.597 . . . . 0.0 111.738 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -136.44 111.08 8.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.21 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.49 -121.26 17.14 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.161 -1.019 . . . . 0.0 110.934 -178.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.452 ' HB3' HG21 ' A' ' 5' ' ' ILE . 23.0 p -101.07 -3.88 28.44 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.515 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.7 t -101.67 138.43 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.97 HD22 HD22 ' A' ' 37' ' ' LEU . 7.9 tp -102.56 123.78 46.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.127 179.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.426 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.3 m -114.48 125.86 54.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 t -151.57 153.83 35.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.774 0.321 . . . . 0.0 111.494 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 8.5 m -93.91 126.18 38.96 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 82.7 m -126.03 142.74 51.39 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -75.58 140.1 42.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.799 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -92.82 143.51 26.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.686 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 37.3 m -51.94 -29.78 21.78 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.753 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.47 3.02 29.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.578 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.79 134.68 6.9 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.793 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 118.27 -174.77 15.43 Favored Glycine 0 C--N 1.318 -0.448 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -178.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -129.34 141.74 51.0 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 117.356 0.578 . . . . 0.0 110.845 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -153.95 130.31 10.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.424 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.1 t -92.51 134.49 34.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.48 -179.435 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.8 p -121.42 157.88 29.56 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.901 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -123.14 146.2 47.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.866 0.365 . . . . 0.0 111.301 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.881 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.7 tt -146.43 143.3 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.869 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -95.98 117.02 29.82 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.848 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.686 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 10.1 mt -96.1 -5.19 41.39 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -178.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.799 ' OD1' HG22 ' A' ' 5' ' ' ILE . 54.3 t30 -44.73 -27.63 0.52 Allowed 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.1 m -81.1 -39.67 25.31 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.74 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -73.49 -53.43 18.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -177.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.606 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.89 147.13 6.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.175 0.512 . . . . 0.0 112.042 -178.502 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.45 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 12.5 tt0 -138.96 166.17 25.18 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.923 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -107.58 99.75 9.22 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.193 0.52 . . . . 0.0 110.767 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.481 HG11 ' HE3' ' A' ' 99' ' ' LYS . 40.6 t -97.93 96.98 5.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.745 179.136 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.465 ' O ' HG22 ' A' ' 25' ' ' THR . 22.3 t0 54.07 33.11 16.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.704 0.288 . . . . 0.0 111.56 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.56 28.45 12.67 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 120.723 -0.751 . . . . 0.0 113.223 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 68.0 p -140.33 135.94 32.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.898 0.38 . . . . 0.0 111.219 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.45 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 31.2 mt -74.21 119.35 18.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.067 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.481 ' HE3' HG11 ' A' ' 94' ' ' VAL . 7.1 mttt -124.29 138.25 54.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.447 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.625 ' CD2' ' CD2' ' A' ' 40' ' ' HIS . 32.5 t80 . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.01 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.437 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 19.7 p90 . . . . . 0 N--CA 1.466 0.336 0 CA-C-O 120.633 0.254 . . . . 0.0 111.444 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.805 HG22 ' OD1' ' A' ' 88' ' ' ASN . 3.8 tp -65.5 -14.43 16.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.707 0.289 . . . . 0.0 111.129 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 mp0 -76.33 -27.23 56.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.786 0.327 . . . . 0.0 110.528 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.3 p -119.23 19.1 12.92 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.181 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.9 m -131.35 154.86 48.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.136 0.494 . . . . 0.0 111.771 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -134.93 173.07 12.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.065 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 p30 49.32 57.12 6.83 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.706 HG21 ' CD1' ' A' ' 5' ' ' ILE . 4.9 p -79.54 130.55 35.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.63 178.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.634 ' O ' HD12 ' A' ' 19' ' ' LEU . 3.4 pt20 -156.43 163.26 39.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.64 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.682 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.98 136.6 38.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.187 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.88 143.17 48.08 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.462 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.3 -150.1 37.93 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.025 -1.083 . . . . 0.0 111.82 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.69 -37.1 18.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -143.23 35.64 1.35 Allowed 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -114.43 146.57 40.45 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.815 0.34 . . . . 0.0 111.484 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.775 ' HB3' HD11 ' A' ' 37' ' ' LEU . 9.9 tp -120.29 123.21 42.6 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.285 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.18 144.63 47.6 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.56 172.55 16.17 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.876 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -112.3 134.31 53.91 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 177.167 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.0 m -130.46 134.83 47.4 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.39 -0.524 . . . . 0.0 112.228 -178.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 6.3 ptpt -67.3 135.51 53.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.326 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.585 HG22 ' O ' ' A' ' 95' ' ' ASP . 64.1 p -85.16 -179.33 6.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.27 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 45.8 mtt-85 -59.3 -29.69 67.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.559 -179.315 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.79 10.68 8.94 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 66.9 39.27 3.39 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.025 0.441 . . . . 0.0 112.005 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -121.44 132.63 54.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.026 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.445 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 46.8 m-85 -90.65 126.46 35.98 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.108 0.48 . . . . 0.0 111.922 -178.517 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.1 m -131.06 151.61 36.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.793 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 41.5 m -71.06 134.6 47.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.228 0.537 . . . . 0.0 111.948 -178.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.3 t -142.11 161.82 37.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.284 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.11 156.02 45.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.321 0.582 . . . . 0.0 112.394 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.455 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -138.46 125.0 25.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.113 -0.949 . . . . 0.0 108.774 179.25 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -87.17 115.92 24.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.649 0.261 . . . . 0.0 111.199 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.865 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -87.17 -16.29 35.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.391 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.86 -45.84 74.62 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.64 0.257 . . . . 0.0 111.467 -178.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.47 -10.4 37.96 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.401 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 28.6 m-70 -97.86 -65.9 0.93 Allowed 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.62 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.9 mp -80.03 149.29 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.295 178.755 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.36 172.68 12.35 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.933 -179.327 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.529 ' C ' HD12 ' A' ' 44' ' ' ILE . 20.0 t30 -112.72 112.27 23.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.219 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.808 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.1 mp -111.85 93.46 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-O 120.865 0.364 . . . . 0.0 110.805 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 38.3 t0 64.78 39.64 6.07 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.206 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.28 1.83 90.38 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.562 -0.828 . . . . 0.0 113.123 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 20.9 m -112.46 137.13 51.11 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 117.187 0.494 . . . . 0.0 111.004 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 66.3 mt -77.72 118.55 20.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.433 0.635 . . . . 0.0 112.326 -177.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.808 ' HB2' HD13 ' A' ' 44' ' ' ILE . 37.5 mttt -139.65 163.34 32.84 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.101 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.743 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.8 m-90 -87.1 121.71 29.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 111.637 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.447 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 38.5 tt0 -175.26 145.3 0.85 Allowed Pre-proline 0 N--CA 1.466 0.332 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.909 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.447 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 37.1 Cg_endo -65.25 71.26 0.28 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.267 1.978 . . . . 0.0 112.797 -179.06 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.405 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -162.48 133.19 4.84 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.47 179.064 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.16 112.4 18.47 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.247 0.546 . . . . 0.0 112.457 -177.634 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.473 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 49.3 p90 -51.56 -30.39 20.56 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.952 178.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.7 p -50.87 -17.36 0.55 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -62.07 -29.46 70.32 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.042 -0.263 . . . . 0.0 110.634 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.438 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -129.04 0.66 5.25 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.664 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.5 m -112.16 147.96 35.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.112 0.482 . . . . 0.0 112.06 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -141.71 157.39 45.11 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.24 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 63.49 44.89 5.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.105 0.479 . . . . 0.0 110.456 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.682 ' O ' HD22 ' A' ' 13' ' ' LEU . 70.7 m -68.51 137.0 54.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.663 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.62 152.6 41.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.822 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.471 ' CG1' HD13 ' A' ' 69' ' ' LEU . 58.3 mt -130.94 140.74 47.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.337 0.589 . . . . 0.0 111.628 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -137.78 109.48 7.07 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.652 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.89 -122.43 13.49 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.675 -178.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.492 ' HB3' HG21 ' A' ' 5' ' ' ILE . 22.4 p -101.78 -2.8 29.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 117.012 0.406 . . . . 0.0 112.085 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.43 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.5 t -102.54 137.3 31.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-O 120.957 0.408 . . . . 0.0 111.752 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.865 HD22 HD22 ' A' ' 37' ' ' LEU . 7.5 tp -100.89 124.08 46.04 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.349 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.448 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -114.24 125.5 53.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.111 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.7 t -151.58 153.59 34.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.794 0.331 . . . . 0.0 111.722 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.1 m -94.42 126.02 39.43 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.3 m -127.7 145.32 50.94 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -178.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -74.86 138.03 42.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.477 177.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 56.4 mtp180 -91.09 142.98 27.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.555 0.217 . . . . 0.0 110.532 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 62.7 m -52.1 -25.13 8.06 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.694 0.283 . . . . 0.0 111.554 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -84.13 1.57 43.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.387 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.42 135.83 7.21 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.839 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.06 -167.34 12.3 Favored Glycine 0 C--N 1.32 -0.335 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -131.99 141.49 49.29 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 117.329 0.564 . . . . 0.0 111.594 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -153.99 129.89 10.19 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.454 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.6 t -92.13 135.18 34.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.737 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.2 p -121.88 158.33 29.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.203 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 4.5 p -121.87 145.65 47.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.797 0.332 . . . . 0.0 111.104 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.712 HD11 ' CH2' ' A' ' 50' ' ' TRP . 13.2 tt -144.42 143.32 23.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.647 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -97.15 117.6 31.7 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.781 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.625 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 6.8 mt -99.4 -4.61 31.16 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -178.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.805 ' OD1' HG22 ' A' ' 5' ' ' ILE . 54.2 t30 -44.82 -29.1 0.73 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -178.358 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.7 m -81.32 -41.67 21.73 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.743 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -70.58 -52.76 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -177.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.581 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.8 mp -83.33 147.59 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.913 0.387 . . . . 0.0 111.543 -179.296 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.419 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 31.3 tt0 -138.51 165.57 26.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.22 -179.033 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -105.96 99.53 9.11 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 121.183 0.516 . . . . 0.0 110.766 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 47.8 t -97.54 97.12 5.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.538 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.585 ' O ' HG22 ' A' ' 25' ' ' THR . 26.0 t0 53.19 33.29 14.95 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.763 0.282 . . . . 0.0 111.763 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.5 28.63 11.13 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.752 -0.737 . . . . 0.0 113.253 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.28 135.24 30.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.931 0.396 . . . . 0.0 110.971 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 79.2 mt -74.01 119.86 18.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.803 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -123.02 131.03 53.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.417 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.423 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 14.2 t80 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.147 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.425 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 13.6 p90 . . . . . 0 N--CA 1.464 0.239 0 CA-C-O 120.673 0.273 . . . . 0.0 111.296 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.736 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.0 tp -63.04 -20.04 24.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.449 -179.518 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -77.64 -25.51 49.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.784 0.326 . . . . 0.0 110.552 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.0 p -118.4 16.66 13.87 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.849 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.3 m -134.13 155.7 49.61 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.99 0.424 . . . . 0.0 111.37 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.41 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.9 ptt180 -132.29 172.9 11.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.945 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.438 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.2 p-10 49.52 57.46 6.48 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.239 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.614 HG21 ' CD1' ' A' ' 5' ' ' ILE . 19.3 p -78.94 132.15 36.62 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.659 ' O ' HD12 ' A' ' 19' ' ' LEU . 8.3 pt20 -157.66 163.85 37.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.616 -179.279 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.676 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.21 136.52 37.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.037 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.9 143.63 47.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.134 179.039 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.15 -152.19 33.51 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 119.849 -1.167 . . . . 0.0 111.534 -178.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.47 -37.01 18.71 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -178.187 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.1 p -141.25 35.65 1.7 Allowed 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.0 OUTLIER -115.69 146.74 41.59 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.156 0.503 . . . . 0.0 111.833 178.873 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.823 ' CB ' HD11 ' A' ' 37' ' ' LEU . 13.3 tp -119.09 124.13 46.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.321 179.023 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.85 143.19 47.12 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.09 172.24 17.15 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.33 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -112.17 133.65 54.18 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 83.7 m -130.97 134.56 46.84 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.2 ptpt -67.03 136.02 54.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.241 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.498 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.8 p -85.77 -177.81 6.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.272 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.8 mmp_? -61.26 -29.32 69.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.87 0.366 . . . . 0.0 110.794 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.44 8.72 8.71 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 66.56 36.35 4.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.262 0.553 . . . . 0.0 111.037 -178.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.419 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 25.2 mt-30 -118.53 136.93 53.55 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.862 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -93.06 124.76 37.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.909 0.385 . . . . 0.0 111.702 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.44 HG22 HG23 ' A' ' 25' ' ' THR . 4.2 m -129.98 149.72 33.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.619 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.2 p -71.02 135.06 47.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.185 0.517 . . . . 0.0 111.88 -178.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.9 t -142.51 161.42 38.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.253 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -142.35 156.72 45.26 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.394 0.616 . . . . 0.0 112.371 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.582 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -139.52 125.18 21.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.087 179.335 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -87.66 120.35 28.89 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.663 0.268 . . . . 0.0 111.289 -178.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.823 HD11 ' CB ' ' A' ' 19' ' ' LEU . 4.2 mp -88.35 -15.29 36.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.825 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.428 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.6 p-10 -57.51 -43.36 84.19 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 5.1 p30 -92.48 -10.58 37.31 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 122.077 -0.389 . . . . 0.0 111.848 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -99.51 -63.33 1.13 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.62 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.5 mp -79.64 147.16 6.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.791 178.642 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.42 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.41 170.05 16.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.654 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.53 ' C ' HD12 ' A' ' 44' ' ' ILE . 27.1 t30 -113.21 111.79 22.66 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.292 -179.267 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.792 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.3 mp -112.37 89.56 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.529 179.137 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.3 t70 68.52 38.81 2.27 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.042 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.95 0.83 90.52 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.624 -0.798 . . . . 0.0 113.426 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.8 m -108.72 135.33 50.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 117.334 0.567 . . . . 0.0 110.507 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.456 HD22 HG21 ' A' ' 41' ' ' ILE . 20.0 mt -77.49 117.0 18.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.65 0.738 . . . . 0.0 111.693 -177.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.792 ' HB2' HD13 ' A' ' 44' ' ' ILE . 10.3 mttm -138.3 163.26 32.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.577 179.687 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.702 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.1 m-90 -88.03 122.4 31.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.856 0.36 . . . . 0.0 111.791 -179.559 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.455 ' CG ' ' O ' ' A' ' 50' ' ' TRP . 26.4 mt-30 -171.16 149.81 2.73 Favored Pre-proline 0 N--CA 1.47 0.53 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.65 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -69.74 66.48 1.76 Allowed 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 121.831 1.687 . . . . 0.0 112.035 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.7 134.57 9.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.967 -1.015 . . . . 0.0 108.732 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -81.54 109.88 16.41 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -178.184 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.437 ' CD1' HG22 ' A' ' 41' ' ' ILE . 38.4 p90 -48.45 -29.73 4.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.576 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.2 p -48.36 -19.36 0.3 Allowed 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -62.46 -24.82 67.65 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.499 -178.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.446 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -133.3 2.4 3.55 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.4 m -112.58 148.53 34.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.13 0.49 . . . . 0.0 112.318 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -139.97 155.51 47.09 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.942 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 64.19 49.63 2.59 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.953 0.406 . . . . 0.0 111.103 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.676 ' O ' HD22 ' A' ' 13' ' ' LEU . 44.9 m -71.34 135.2 47.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.788 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.505 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.85 151.93 41.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.507 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.462 ' CG1' HD13 ' A' ' 69' ' ' LEU . 38.1 mt -129.94 140.49 48.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.27 0.557 . . . . 0.0 111.848 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -136.6 110.63 8.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.507 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.32 -121.87 16.71 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.224 -0.989 . . . . 0.0 110.887 -178.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.424 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.6 p -101.54 -3.21 28.9 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.581 HG13 ' O ' ' A' ' 85' ' ' ILE . 9.0 t -102.86 140.7 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 120.985 0.421 . . . . 0.0 111.814 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.807 HD22 HD22 ' A' ' 37' ' ' LEU . 9.2 tp -102.85 126.79 50.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.498 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.418 ' N ' HD12 ' A' ' 69' ' ' LEU . 5.6 m -115.21 124.23 50.87 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 t -151.78 153.64 34.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.742 0.306 . . . . 0.0 111.288 -178.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.8 m -94.42 125.7 39.23 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 75.2 m -126.16 143.41 51.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.435 0.636 . . . . 0.0 112.514 -178.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -75.7 139.53 41.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.89 178.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 47.8 mtp85 -93.55 144.63 25.19 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.754 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.6 m -51.85 -28.39 15.76 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.786 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -83.15 1.98 37.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.497 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.2 136.69 7.48 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.778 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.7 -170.78 13.51 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -131.22 141.85 50.09 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.238 0.519 . . . . 0.0 111.121 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 41.0 t30 -154.14 129.49 9.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.347 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.2 t -92.72 134.78 34.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.714 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.4 p -121.83 158.48 28.82 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.546 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 46.0 m -121.9 143.96 49.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.359 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.699 HD11 ' CH2' ' A' ' 50' ' ' TRP . 12.6 tt -145.11 143.08 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.843 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -96.97 116.26 28.88 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.035 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.61 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 9.8 mt -97.44 -6.83 33.04 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.736 ' OD1' HG22 ' A' ' 5' ' ' ILE . 37.6 t30 -45.1 -27.53 0.6 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -178.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 61.7 m -81.88 -41.15 21.37 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.702 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.9 m -71.65 -51.18 34.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -178.056 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.618 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.8 mp -82.8 147.51 5.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.965 0.412 . . . . 0.0 111.182 -179.172 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -138.38 166.58 23.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.04 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -107.64 99.77 9.23 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.074 0.464 . . . . 0.0 110.629 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.5 t -98.36 97.11 5.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.868 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.498 ' O ' HG22 ' A' ' 25' ' ' THR . 34.2 t0 52.83 33.2 13.75 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.24 28.72 11.2 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.581 -0.819 . . . . 0.0 113.371 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 54.1 p -141.1 134.96 30.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.925 0.393 . . . . 0.0 111.289 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.427 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 41.1 mt -73.31 119.16 17.16 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.681 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.3 mttm -125.21 139.32 53.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.639 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 34.7 t80 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.59 179.769 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.456 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 15.6 p90 . . . . . 0 N--CA 1.466 0.327 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.76 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.0 tp -61.77 -20.76 24.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.663 0.268 . . . . 0.0 111.618 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -75.92 -23.92 55.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.198 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.0 p -118.17 8.43 12.36 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 m -125.39 154.86 41.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.077 0.465 . . . . 0.0 111.226 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.2 173.18 11.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.814 -179.766 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.416 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.8 p-10 49.18 58.13 5.72 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.005 0.431 . . . . 0.0 112.152 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.609 HG21 ' CD1' ' A' ' 5' ' ' ILE . 9.9 p -79.57 131.98 36.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.784 178.43 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.742 ' O ' HD12 ' A' ' 19' ' ' LEU . 11.5 pt20 -157.45 163.72 38.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.448 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.745 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.37 136.72 37.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.841 -179.65 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.85 143.9 47.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.435 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.35 -151.01 36.49 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 119.927 -1.13 . . . . 0.0 111.522 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.28 -37.2 18.8 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.463 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.18 35.86 1.53 Allowed 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -114.36 149.99 35.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.02 0.438 . . . . 0.0 111.806 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.767 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.3 tp -123.56 124.22 42.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.546 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.42 144.31 47.01 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.865 0.364 . . . . 0.0 110.196 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.38 172.24 16.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.373 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -111.52 134.12 53.31 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 64.2 m -131.01 132.32 44.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.141 0.496 . . . . 0.0 112.103 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.433 ' HB3' ' CE2' ' A' ' 30' ' ' PHE . 1.9 ptpt -66.41 136.93 56.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.219 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.474 HG22 ' O ' ' A' ' 95' ' ' ASP . 82.6 p -85.86 -178.47 6.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.481 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 29.9 mtt180 -60.82 -30.06 69.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.766 0.317 . . . . 0.0 111.03 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.78 9.06 8.6 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 66.96 37.32 3.93 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.145 0.497 . . . . 0.0 111.635 -178.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 47.0 mt-30 -118.5 135.46 54.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.009 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.433 ' CE2' ' HB3' ' A' ' 24' ' ' LYS . 77.5 m-85 -92.34 124.61 36.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.994 0.426 . . . . 0.0 111.879 -178.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.6 m -129.88 148.24 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.295 179.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.4 t -70.14 136.49 50.18 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.305 0.574 . . . . 0.0 111.814 -178.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.7 t -143.14 161.53 37.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.994 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.3 ttpt -142.6 157.12 45.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.289 0.566 . . . . 0.0 111.901 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.462 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -138.6 127.13 29.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.29 179.592 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -87.68 117.02 26.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.629 0.252 . . . . 0.0 111.511 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.84 HD22 HD22 ' A' ' 69' ' ' LEU . 4.2 mp -86.11 -16.18 38.8 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.61 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -55.08 -48.03 74.09 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.886 -178.625 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.439 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.6 OUTLIER -92.08 -10.06 40.42 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 122.26 -0.275 . . . . 0.0 111.508 179.536 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.415 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 23.4 m-70 -96.5 -69.54 0.75 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.621 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.8 mp -79.34 151.36 4.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.137 178.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.421 ' HB1' ' OG ' ' A' ' 53' ' ' SER . . . -141.74 172.38 12.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.956 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.58 HD22 ' HA2' ' A' ' 46' ' ' GLY . 27.3 t-20 -112.82 113.1 25.04 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.971 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.887 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.6 mp -113.25 89.95 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.818 0.342 . . . . 0.0 111.327 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 39.6 t0 69.32 38.77 1.78 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.587 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.58 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 84.15 3.37 88.97 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 120.598 -0.81 . . . . 0.0 113.061 179.428 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 52.1 m -115.89 137.4 52.14 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.944 0.402 . . . . 0.0 111.124 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.9 mt -77.45 116.64 18.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.569 0.699 . . . . 0.0 111.925 -177.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.887 ' HB2' HD13 ' A' ' 44' ' ' ILE . 38.3 mttt -137.22 162.56 33.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.701 -1.136 . . . . 0.0 109.527 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.728 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 6.1 m-90 -87.67 124.1 33.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.103 0.478 . . . . 0.0 112.062 -179.063 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.441 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 52.1 tt0 -176.33 149.72 0.97 Allowed Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.179 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.441 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 12.3 Cg_exo -67.94 66.15 0.93 Allowed 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.27 1.98 . . . . 0.0 112.485 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.421 ' OG ' ' HB1' ' A' ' 42' ' ' ALA . 3.1 p -155.92 135.44 12.44 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.726 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.435 ' ND2' ' N ' ' A' ' 54' ' ' ASN . 0.0 OUTLIER -82.62 106.6 14.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.216 0.532 . . . . 0.0 112.313 -177.701 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.463 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 33.8 p90 -47.78 -30.18 3.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.532 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.6 p -49.35 -18.03 0.33 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.893 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -64.78 -26.93 68.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.569 0.223 . . . . 0.0 111.6 -178.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.3 p -128.68 -3.42 5.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.558 0.218 . . . . 0.0 111.485 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.8 m -109.2 148.96 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.207 0.527 . . . . 0.0 111.894 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.4 p90 -142.23 157.35 44.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.946 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.6 m-20 63.21 45.44 5.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.043 0.449 . . . . 0.0 110.75 -179.391 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.745 ' O ' HD22 ' A' ' 13' ' ' LEU . 21.4 m -69.25 137.08 52.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.604 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -141.38 151.17 43.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.489 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.542 HG21 HD13 ' A' ' 19' ' ' LEU . 24.3 mt -129.29 140.27 49.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.297 0.57 . . . . 0.0 111.823 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -136.77 108.92 7.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.238 -0.892 . . . . 0.0 108.98 179.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.75 -120.53 11.13 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.264 -0.97 . . . . 0.0 111.077 -178.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.438 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 20.6 p -103.33 -0.86 29.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.808 0.304 . . . . 0.0 111.514 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.492 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.7 t -103.61 139.11 25.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-O 120.934 0.397 . . . . 0.0 111.709 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.84 HD22 HD22 ' A' ' 37' ' ' LEU . 11.6 tp -103.94 124.9 49.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.345 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.3 m -114.86 125.22 53.41 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -152.13 153.88 34.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.625 0.25 . . . . 0.0 111.438 -178.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.4 m -94.26 125.8 39.11 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.493 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.523 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 96.1 m -123.87 142.38 51.17 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -73.7 137.31 43.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.873 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 18.7 mtm180 -91.45 142.39 27.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.694 0.283 . . . . 0.0 110.322 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.9 m -52.0 -28.99 18.87 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -83.73 3.82 31.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.656 0.265 . . . . 0.0 111.641 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.92 135.65 7.37 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.905 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.35 -171.95 14.0 Favored Glycine 0 C--N 1.319 -0.378 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -178.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -131.28 144.02 50.98 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 117.308 0.554 . . . . 0.0 111.263 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -154.2 129.53 9.77 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.302 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.6 t -92.54 134.88 34.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.74 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 81.3 p -122.35 158.07 30.43 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.317 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.9 m -122.9 144.06 49.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.871 0.367 . . . . 0.0 111.148 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.728 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.5 tt -145.65 143.99 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.895 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -97.58 116.3 29.52 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.798 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.636 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 6.0 mt -98.31 -6.64 30.53 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.76 ' OD1' HG22 ' A' ' 5' ' ' ILE . 37.3 t30 -44.98 -27.98 0.61 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -178.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.0 t -81.93 -39.81 23.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.721 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -72.49 -52.08 25.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.334 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.553 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.53 147.64 5.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.007 0.432 . . . . 0.0 110.86 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 99' ' ' LYS . 10.9 tt0 -139.31 166.71 23.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.207 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -107.5 99.94 9.4 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.101 0.477 . . . . 0.0 110.662 -179.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.491 HG21 ' HG3' ' A' ' 99' ' ' LYS . 61.7 t -100.38 97.96 6.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.04 179.254 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.474 ' O ' HG22 ' A' ' 25' ' ' THR . 25.1 t0 53.53 32.03 13.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.656 0.265 . . . . 0.0 111.672 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.93 28.55 10.85 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.619 -0.801 . . . . 0.0 113.369 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 36.1 t -140.93 134.45 29.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.902 0.382 . . . . 0.0 111.193 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.41 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 42.9 mt -73.01 119.51 17.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.75 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.491 ' HG3' HG21 ' A' ' 94' ' ' VAL . 26.2 mmtt -122.99 132.17 54.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.072 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.415 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 13.2 t80 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.61 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.485 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 18.2 p90 . . . . . 0 N--CA 1.466 0.327 0 CA-C-O 120.527 0.203 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.831 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.3 tp -62.22 -22.31 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.778 0.323 . . . . 0.0 111.239 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -73.06 -24.43 60.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.832 0.349 . . . . 0.0 110.852 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.7 p -119.19 17.37 13.17 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.871 0.367 . . . . 0.0 111.723 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.9 m -133.21 155.28 49.63 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.0 0.428 . . . . 0.0 110.919 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.0 ptt85 -135.64 172.93 12.3 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.403 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.428 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.1 p-10 48.29 57.93 5.68 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.736 -0.666 . . . . 0.0 112.445 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.719 HG21 ' CD1' ' A' ' 5' ' ' ILE . 22.0 p -78.99 135.55 36.94 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.05 178.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.721 ' O ' HD12 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -158.91 163.52 36.48 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.039 0.447 . . . . 0.0 111.678 -179.407 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.734 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.61 136.5 37.91 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.807 179.897 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.9 143.14 48.11 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.407 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.61 -149.14 33.4 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 119.944 -1.122 . . . . 0.0 111.887 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -87.3 -37.77 16.87 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -177.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.8 p -141.62 36.36 1.64 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -115.93 149.64 38.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.257 0.551 . . . . 0.0 111.976 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.821 ' CB ' HD11 ' A' ' 37' ' ' LEU . 14.0 tp -123.49 123.79 41.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.768 178.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.91 142.68 47.07 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.64 172.78 15.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.523 -178.415 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -113.36 134.12 54.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.404 ' SG ' HD21 ' A' ' 98' ' ' LEU . 83.9 m -131.19 132.84 44.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.924 0.392 . . . . 0.0 111.82 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 5.2 ptpt -64.63 138.9 58.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.228 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.466 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.5 p -86.97 -176.87 5.9 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.506 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -61.02 -30.65 70.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.884 0.373 . . . . 0.0 111.277 -179.576 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.13 10.48 8.13 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -178.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 67.43 37.72 3.41 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.165 0.507 . . . . 0.0 111.216 -178.572 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -119.06 133.58 55.72 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.363 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.434 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 34.3 m-85 -91.3 125.42 36.06 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.115 0.483 . . . . 0.0 112.101 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.9 m -128.65 151.64 35.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.934 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.5 p -71.29 132.89 45.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.263 0.554 . . . . 0.0 111.784 -178.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.0 t -142.09 162.35 35.71 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.183 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.11 154.7 43.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.378 0.608 . . . . 0.0 111.85 -179.008 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.76 125.78 41.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 179.235 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -88.02 117.49 26.93 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.952 -178.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.821 HD11 ' CB ' ' A' ' 19' ' ' LEU . 3.4 mp -87.87 -15.87 35.53 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.0 p-10 -57.72 -44.86 86.28 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -177.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.434 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 3.5 m-20 -91.86 -9.97 41.42 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 122.047 -0.408 . . . . 0.0 111.247 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.458 ' CD2' ' CD2' ' A' ' 100' ' ' TYR . 3.8 m80 -93.28 -63.55 1.2 Allowed 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.645 ' CD1' HD23 ' A' ' 37' ' ' LEU . 34.9 mt -83.05 154.03 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.965 178.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.59 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -142.0 171.89 13.44 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.257 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.604 ' C ' HD12 ' A' ' 44' ' ' ILE . 25.8 t30 -112.6 111.36 22.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.618 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.813 HD13 ' HB2' ' A' ' 49' ' ' LYS . 1.9 mp -111.7 88.56 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-O 121.05 0.452 . . . . 0.0 110.736 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 52.3 t0 67.91 39.39 2.58 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.16 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.1 2.68 90.56 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.741 -0.743 . . . . 0.0 113.348 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.6 m -109.92 136.38 49.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.199 0.499 . . . . 0.0 111.264 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.425 HD12 ' O ' ' A' ' 83' ' ' SER . 23.6 mt -77.1 116.29 17.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.701 0.762 . . . . 0.0 111.465 -178.072 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.813 ' HB2' HD13 ' A' ' 44' ' ' ILE . 41.3 mttt -139.43 163.52 32.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.684 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.799 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 9.5 m-90 -88.64 127.52 35.57 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.409 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.59 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.6 OUTLIER -174.46 151.96 1.65 Allowed Pre-proline 0 N--CA 1.469 0.519 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.539 -179.772 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.434 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 63.7 Cg_endo -74.12 66.17 5.2 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 121.945 1.763 . . . . 0.0 112.485 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -162.36 133.2 4.94 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.7 -1.136 . . . . 0.0 107.969 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.1 114.22 17.86 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -177.219 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 39.5 p90 -48.95 -29.24 4.56 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.386 177.778 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.6 p -49.83 -18.89 0.56 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.356 -178.638 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -60.8 -26.53 67.37 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.639 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.407 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.5 p -131.16 1.65 4.23 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.1 m -113.76 147.35 38.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.298 0.57 . . . . 0.0 112.481 -178.257 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.3 p90 -141.24 157.91 44.61 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.073 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 64.99 45.71 3.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.997 0.427 . . . . 0.0 111.39 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.734 ' O ' HD22 ' A' ' 13' ' ' LEU . 46.4 m -67.82 135.51 52.69 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.639 179.59 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.494 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.56 151.8 41.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.561 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.483 ' CG1' HD13 ' A' ' 69' ' ' LEU . 48.3 mt -130.15 139.75 50.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.315 0.579 . . . . 0.0 111.907 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -134.05 109.09 8.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.932 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 65.59 -119.37 13.77 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.215 -0.993 . . . . 0.0 111.205 -178.564 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 19.4 p -101.53 -5.59 24.97 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.6 t -101.03 138.27 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 120.872 0.368 . . . . 0.0 111.583 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.817 HD22 HD22 ' A' ' 37' ' ' LEU . 7.7 tp -101.12 125.7 47.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.138 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.483 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.0 m -115.07 125.55 53.66 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.8 t -151.4 153.16 34.17 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.331 -178.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.437 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.4 m -93.91 126.0 38.86 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 89.7 m -126.58 144.6 50.84 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.506 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -73.36 134.99 44.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.48 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.0 mtp85 -92.09 142.88 27.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.647 0.26 . . . . 0.0 110.654 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 33.1 m -51.54 -28.2 13.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.67 -178.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -82.11 1.87 34.01 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.538 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.81 133.72 6.53 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.997 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.3 -167.48 12.5 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.18 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -130.89 142.15 50.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.797 0.298 . . . . 0.0 111.178 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -154.74 130.79 10.23 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.685 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.437 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -93.82 134.46 36.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.102 0.477 . . . . 0.0 111.574 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.425 ' O ' HD12 ' A' ' 48' ' ' LEU . 24.3 p -120.67 158.93 26.36 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.636 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.3 p -123.92 145.85 48.86 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.859 0.361 . . . . 0.0 111.191 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.799 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.2 tt -144.89 143.33 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.637 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -96.92 116.93 30.05 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.419 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.621 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 6.9 mt -95.83 -4.71 43.28 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -178.778 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.831 ' OD1' HG22 ' A' ' 5' ' ' ILE . 56.1 t30 -43.76 -29.31 0.51 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.289 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.3 m -81.77 -40.43 22.65 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.697 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.5 m -70.86 -53.17 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.765 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.579 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -83.13 145.29 8.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.281 0.562 . . . . 0.0 112.052 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.409 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 16.1 tt0 -135.75 165.49 25.47 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.942 -178.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -107.18 99.84 9.35 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.971 0.415 . . . . 0.0 111.141 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 25.7 t -99.53 99.34 8.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.798 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.466 ' O ' HG22 ' A' ' 25' ' ' THR . 28.9 t0 53.08 32.09 12.39 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.773 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.15 28.83 10.26 Favored Glycine 0 C--N 1.329 0.144 0 C-N-CA 120.579 -0.82 . . . . 0.0 113.149 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 t -141.01 135.95 31.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.864 0.364 . . . . 0.0 111.029 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.409 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 67.5 mt -74.6 121.3 21.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.0 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -127.24 137.21 52.83 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-O 121.065 0.46 . . . . 0.0 112.202 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.458 ' CD2' ' CD2' ' A' ' 40' ' ' HIS . 35.8 t80 . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.686 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.453 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 23.1 p90 . . . . . 0 N--CA 1.464 0.266 0 CA-C-O 120.48 0.181 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.803 HG22 ' OD1' ' A' ' 88' ' ' ASN . 7.3 tp -65.5 -15.68 19.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.696 0.284 . . . . 0.0 111.334 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -75.4 -25.24 57.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.764 0.316 . . . . 0.0 110.659 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.9 p -118.8 18.19 13.36 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.465 179.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.2 m -133.41 154.76 50.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.947 0.403 . . . . 0.0 111.441 -179.24 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -133.69 172.74 12.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.174 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 49.0 57.77 6.09 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.209 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.675 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.2 p -79.39 133.11 36.57 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.394 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.647 ' O ' HD12 ' A' ' 19' ' ' LEU . 18.5 pt20 -157.76 163.77 37.75 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.399 -178.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.739 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.35 135.4 39.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.574 179.748 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -118.9 143.54 46.94 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.195 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.69 -151.49 33.06 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 119.891 -1.147 . . . . 0.0 111.465 -178.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.64 -37.19 18.27 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.087 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.8 35.24 1.78 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.6 mp0 -115.91 146.96 41.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.017 0.437 . . . . 0.0 111.775 179.173 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.794 ' CB ' HD11 ' A' ' 37' ' ' LEU . 10.2 tp -119.75 124.91 47.35 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 178.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.89 143.58 47.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.922 0.392 . . . . 0.0 110.486 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.35 172.46 16.53 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.164 -178.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.33 133.88 54.18 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 177.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.6 m -130.54 133.16 46.01 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.255 0.55 . . . . 0.0 111.935 -178.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 4.5 ptpt -66.45 136.05 55.15 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.273 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 95' ' ' ASP . 69.2 p -85.29 -177.59 6.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.577 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.0 mmt85 -60.8 -29.7 69.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.681 0.276 . . . . 0.0 111.263 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.11 9.32 10.67 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 66.68 37.84 4.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.159 0.504 . . . . 0.0 111.528 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.422 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 67.6 mt-30 -117.22 135.83 53.51 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.746 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -92.42 125.16 36.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 111.836 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 m -130.37 151.19 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.819 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.8 m -72.1 134.19 45.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.194 0.521 . . . . 0.0 111.558 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.2 t -142.68 161.45 38.05 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.188 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -142.82 156.34 44.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.473 0.654 . . . . 0.0 112.276 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.514 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -136.47 124.42 34.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.468 179.127 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -87.75 119.55 28.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.717 0.294 . . . . 0.0 110.752 -178.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.805 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -88.84 -14.86 35.94 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.462 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 6.4 p-10 -56.04 -46.54 78.83 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.462 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.1 p30 -92.36 -10.0 39.78 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 122.081 -0.387 . . . . 0.0 111.564 179.176 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 7.4 m80 -96.33 -64.6 1.03 Allowed 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.576 HD13 ' CD1' ' A' ' 50' ' ' TRP . 33.0 mm -80.52 147.54 6.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.541 178.665 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.418 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.18 171.55 13.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.772 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.556 ' C ' HD12 ' A' ' 44' ' ' ILE . 22.7 t30 -113.18 112.53 23.94 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.033 -179.321 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.736 HD13 ' HB2' ' A' ' 49' ' ' LYS . 1.9 mp -110.61 89.4 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.726 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 52.7 t0 67.55 39.39 2.84 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.402 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.74 0.75 87.63 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.674 -0.774 . . . . 0.0 113.263 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.1 m -112.63 135.28 53.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.15 0.475 . . . . 0.0 110.632 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.1 mt -77.34 118.9 20.27 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.553 0.692 . . . . 0.0 111.305 -178.107 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.736 ' HB2' HD13 ' A' ' 44' ' ' ILE . 17.9 mttt -136.82 162.75 32.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.851 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.774 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.2 m-90 -85.54 119.83 26.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.941 0.4 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.417 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 29.8 tt0 -173.77 148.31 1.43 Allowed Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.28 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.417 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 13.0 Cg_exo -67.22 65.53 0.67 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.317 2.011 . . . . 0.0 112.833 -179.055 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.2 p -157.63 134.35 9.91 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.823 178.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.434 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.0 109.28 15.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.125 0.488 . . . . 0.0 112.059 -178.034 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.432 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 32.7 p90 -48.45 -29.09 3.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.532 178.658 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.8 p -48.65 -19.34 0.34 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.687 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -62.36 -25.25 67.81 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 121.066 -0.254 . . . . 0.0 111.271 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.451 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -133.82 3.4 3.49 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.2 m -115.36 149.49 37.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.269 0.557 . . . . 0.0 112.34 -178.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -143.03 157.81 44.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.782 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 64.28 46.19 3.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.903 0.383 . . . . 0.0 110.512 -178.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.739 ' O ' HD22 ' A' ' 13' ' ' LEU . 72.4 m -70.12 135.33 49.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.689 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.478 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.63 152.04 42.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.768 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.468 ' CG1' HD13 ' A' ' 69' ' ' LEU . 22.0 mt -129.71 140.18 49.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.305 0.574 . . . . 0.0 111.762 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -135.6 108.92 7.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.044 179.038 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.94 -120.99 13.18 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.081 -178.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.421 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.8 p -102.11 -3.93 26.73 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.416 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.5 t -101.83 139.95 21.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-O 120.902 0.382 . . . . 0.0 111.561 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.805 HD22 HD22 ' A' ' 37' ' ' LEU . 5.6 tp -104.08 128.88 51.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.854 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.631 ' N ' HD12 ' A' ' 69' ' ' LEU . 7.5 m -118.09 127.11 53.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.417 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -151.93 153.34 33.92 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.276 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.7 m -94.59 125.83 39.49 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 78.8 m -126.18 144.56 50.72 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.62 137.31 42.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.645 178.163 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.0 mtp85 -92.56 144.64 25.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.706 0.289 . . . . 0.0 110.591 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.3 m -51.87 -28.06 14.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.7 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -83.43 1.95 39.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.667 0.27 . . . . 0.0 111.554 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.29 136.97 7.17 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.655 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.39 -171.27 13.69 Favored Glycine 0 C--N 1.32 -0.352 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -130.06 141.12 50.75 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.296 0.548 . . . . 0.0 111.212 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -153.93 130.67 10.8 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.232 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.2 t -93.57 134.95 35.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.681 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 92.3 p -123.24 158.33 31.12 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.298 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.1 p -123.42 146.47 47.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.257 -179.616 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.716 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 14.1 tt -145.41 143.1 22.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.584 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -95.79 119.13 33.73 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.971 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.545 ' HB3' HD12 ' A' ' 91' ' ' ILE . 10.9 mt -99.26 -5.65 29.46 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -178.766 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.803 ' OD1' HG22 ' A' ' 5' ' ' ILE . 51.8 t30 -44.75 -28.2 0.6 Allowed 'General case' 0 N--CA 1.467 0.404 0 O-C-N 122.081 -0.387 . . . . 0.0 111.982 -178.339 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.0 t -82.35 -40.06 21.91 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.774 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -72.4 -53.0 20.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -178.052 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.654 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -83.41 147.44 5.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.017 0.437 . . . . 0.0 111.339 -179.016 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 99' ' ' LYS . 11.9 tt0 -138.33 165.86 25.68 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.974 -178.759 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -108.45 100.13 9.44 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.156 0.503 . . . . 0.0 110.586 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.9 t -98.97 98.59 7.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.072 179.414 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.432 ' O ' HG22 ' A' ' 25' ' ' THR . 26.2 t0 53.06 33.74 15.62 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 111.752 0.278 . . . . 0.0 111.752 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.46 28.56 12.59 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.344 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.8 m -140.68 136.07 32.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.861 0.362 . . . . 0.0 111.296 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.42 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 59.3 mt -74.39 119.25 18.34 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.5 mmtt -125.17 138.23 54.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.374 -179.272 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.453 ' CE1' ' HB ' ' A' ' 90' ' ' VAL . 89.0 t80 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.344 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.446 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 30.1 p90 . . . . . 0 N--CA 1.463 0.182 0 N-CA-C 111.648 0.24 . . . . 0.0 111.648 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.741 HG22 ' OD1' ' A' ' 88' ' ' ASN . 7.5 tp -63.49 -17.29 19.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.912 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.76 -26.82 57.75 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.943 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.9 p -118.96 20.8 12.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.283 179.093 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 65.7 m -136.34 154.74 50.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.033 0.444 . . . . 0.0 111.407 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 ptm85 -133.78 173.16 11.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.192 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 48.85 57.82 5.99 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.072 -0.513 . . . . 0.0 112.106 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.616 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.1 p -79.06 131.96 36.44 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 178.494 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.746 ' O ' HD12 ' A' ' 19' ' ' LEU . 6.4 pt20 -157.56 164.02 37.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.892 0.377 . . . . 0.0 111.743 -178.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.711 HD22 ' O ' ' A' ' 62' ' ' SER . 0.9 OUTLIER -97.41 136.01 38.47 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.056 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.11 143.84 47.95 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.63 -151.78 32.21 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 119.797 -1.192 . . . . 0.0 111.608 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.0 -37.5 18.9 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -178.109 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -142.12 36.56 1.55 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -115.51 147.29 40.83 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.985 0.421 . . . . 0.0 111.704 178.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.781 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.0 tp -120.55 123.66 43.42 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.646 ' HB2' ' HE2' ' A' ' 34' ' ' LYS . . . -118.55 143.85 46.47 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.4 172.74 15.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.522 -178.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -112.34 133.55 54.38 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 177.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 84.5 m -130.8 133.97 46.44 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 8.5 ptpt -66.51 134.86 53.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.011 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.527 HG22 ' O ' ' A' ' 95' ' ' ASP . 70.8 p -84.05 -176.2 6.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.504 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.25 -30.5 70.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.753 0.311 . . . . 0.0 111.036 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.64 10.04 8.28 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 66.89 37.77 3.9 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.151 0.5 . . . . 0.0 111.778 -179.05 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.431 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 66.6 mt-30 -120.32 135.19 55.1 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.015 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.434 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 30.4 m-85 -92.93 125.09 37.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.136 0.493 . . . . 0.0 111.708 -178.577 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 22.9 m -128.25 153.08 37.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.607 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.7 m -72.65 134.37 45.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.144 0.497 . . . . 0.0 111.807 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.5 t -144.38 161.55 38.72 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.349 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.646 ' HE2' ' HB2' ' A' ' 20' ' ' ALA . 12.1 ttmt -144.29 156.47 44.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.21 0.529 . . . . 0.0 111.895 -179.157 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.422 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.3 tp -134.91 129.76 51.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.027 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -88.98 115.48 26.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.63 0.252 . . . . 0.0 111.48 -178.331 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.878 HD22 HD22 ' A' ' 69' ' ' LEU . 4.0 mp -87.0 -14.99 40.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.511 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -46.18 79.2 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -178.417 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -92.23 -10.0 40.15 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 7.1 m80 -96.7 -64.93 1.0 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.548 HD11 HD22 ' A' ' 87' ' ' LEU . 21.1 mm -79.86 146.03 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.537 178.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -137.82 171.34 14.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.804 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.426 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 28.9 t30 -111.4 108.01 17.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.618 -179.336 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.5 mm -108.65 89.06 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.645 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 54.8 t0 66.13 39.0 4.47 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.305 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.14 0.47 89.58 Favored Glycine 0 CA--C 1.519 0.32 0 C-N-CA 120.872 -0.68 . . . . 0.0 113.32 179.193 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 52.6 m -110.16 136.36 49.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.077 0.439 . . . . 0.0 110.78 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.2 mt -77.23 117.52 18.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.639 0.733 . . . . 0.0 111.359 -178.015 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -137.57 162.54 33.5 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 114.706 -1.134 . . . . 0.0 110.354 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.731 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.9 m-90 -86.91 119.3 26.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.992 0.425 . . . . 0.0 111.072 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.42 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 15.4 tt0 -173.05 143.24 1.08 Allowed Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.658 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 32.0 Cg_endo -64.72 72.59 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.019 1.812 . . . . 0.0 112.544 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.2 p -162.85 136.01 5.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.87 -1.059 . . . . 0.0 108.882 179.364 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -83.01 109.88 17.48 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.28 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.423 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 29.4 p90 -49.95 -30.31 10.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.919 178.539 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.1 p -49.17 -18.58 0.35 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -63.22 -25.49 68.36 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.853 -0.339 . . . . 0.0 111.455 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.426 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.8 p -131.5 -0.64 3.96 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.545 179.443 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.3 m -109.72 148.62 31.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.113 0.482 . . . . 0.0 112.016 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -142.4 157.38 44.84 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.684 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 21.5 m120 63.38 45.08 5.07 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.61 -179.278 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.711 ' O ' HD22 ' A' ' 13' ' ' LEU . 67.6 m -68.0 137.37 55.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.56 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.88 152.44 42.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.801 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.534 HG21 HD13 ' A' ' 19' ' ' LEU . 35.4 mt -130.93 139.29 51.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.291 0.567 . . . . 0.0 111.932 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -136.86 110.32 7.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.82 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.73 -121.54 12.53 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.466 -0.874 . . . . 0.0 111.202 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.422 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.8 p -101.61 -4.32 26.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.603 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.1 t -101.54 141.12 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.878 HD22 HD22 ' A' ' 37' ' ' LEU . 9.3 tp -102.71 123.53 46.57 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.439 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.402 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.3 m -114.46 124.4 51.83 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.3 t -152.15 153.8 34.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.63 0.252 . . . . 0.0 111.399 -178.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 16.3 m -94.85 126.56 40.25 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 87.9 m -125.86 145.49 50.22 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -75.06 136.45 41.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.261 177.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 45.3 mtp180 -93.07 144.47 25.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.714 0.292 . . . . 0.0 110.944 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 46.8 m -52.21 -25.87 10.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.641 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -82.36 0.28 42.54 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.76 0.314 . . . . 0.0 111.174 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.45 135.38 7.03 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.89 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 113.83 -166.04 12.11 Favored Glycine 0 C--N 1.319 -0.378 0 N-CA-C 111.447 -0.661 . . . . 0.0 111.447 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -131.41 143.82 50.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 117.148 0.474 . . . . 0.0 111.295 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -154.25 130.79 10.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.267 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.0 t -94.31 134.88 36.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.664 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.6 p -123.27 158.41 31.01 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.662 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.7 p -122.64 146.63 47.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.849 0.357 . . . . 0.0 111.174 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.674 HD11 ' CH2' ' A' ' 50' ' ' TRP . 12.9 tt -145.81 143.2 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.803 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -97.1 117.29 30.97 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.853 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.651 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 11.1 mt -98.78 -4.62 32.94 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -178.469 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.741 ' OD1' HG22 ' A' ' 5' ' ' ILE . 55.7 t30 -44.77 -27.25 0.48 Allowed 'General case' 0 N--CA 1.469 0.515 0 O-C-N 122.0 -0.438 . . . . 0.0 112.101 -178.389 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.1 t -81.77 -41.94 20.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.731 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.0 m -70.72 -52.45 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -177.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.651 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -83.43 147.1 6.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 120.941 0.401 . . . . 0.0 111.58 -178.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 36.1 tt0 -137.71 164.29 29.23 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.886 -178.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -106.04 99.69 9.27 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-O 121.195 0.522 . . . . 0.0 110.697 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -98.05 97.56 6.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.29 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.527 ' O ' HG22 ' A' ' 25' ' ' THR . 30.8 t0 52.46 32.29 11.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.61 0.243 . . . . 0.0 111.617 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.38 28.42 10.61 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.823 -0.703 . . . . 0.0 113.429 179.301 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.8 t -142.07 136.24 29.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.833 0.349 . . . . 0.0 111.463 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.466 HD22 HG21 ' A' ' 91' ' ' ILE . 78.9 mt -74.35 120.51 20.02 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.718 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 17.3 mttt -126.35 145.76 50.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.949 -178.68 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 53.3 t80 . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.103 179.874 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 25.5 p90 . . . . . 0 N--CA 1.464 0.241 0 CA-C-O 120.63 0.253 . . . . 0.0 111.409 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.817 HG22 ' OD1' ' A' ' 88' ' ' ASN . 5.1 tp -66.4 -14.6 17.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.713 0.292 . . . . 0.0 111.447 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -77.29 -27.52 53.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 0.0 110.683 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.9 p -118.68 19.11 13.3 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.258 179.278 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.6 m -133.1 154.48 50.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.04 0.448 . . . . 0.0 111.374 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.59 172.41 12.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.964 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 p30 49.4 57.68 6.23 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.704 HG21 ' CD1' ' A' ' 5' ' ' ILE . 40.4 p -79.85 133.17 36.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 177.812 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.809 ' O ' HD12 ' A' ' 19' ' ' LEU . 8.5 pt20 -158.56 163.89 36.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.592 -179.234 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.703 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.56 136.47 37.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.268 0.556 . . . . 0.0 111.167 -179.745 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.22 143.26 48.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.282 179.148 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.14 -150.31 37.0 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 119.884 -1.15 . . . . 0.0 111.565 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -86.29 -37.12 18.87 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -178.387 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.19 35.33 1.52 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.83 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -114.67 149.65 36.4 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.986 0.422 . . . . 0.0 111.679 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.809 HD12 ' O ' ' A' ' 12' ' ' GLN . 14.2 tp -122.87 123.89 42.0 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.35 143.12 47.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.877 0.37 . . . . 0.0 110.212 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.82 172.86 15.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.255 -178.678 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -109.36 135.08 51.0 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.181 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.6 m -130.61 131.86 45.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.154 0.502 . . . . 0.0 111.415 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 0.4 OUTLIER -66.03 137.06 56.83 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.459 -179.491 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.8 p -86.52 -178.15 6.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.481 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.3 mmt180 -60.38 -29.05 68.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.714 0.293 . . . . 0.0 111.247 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.85 9.18 10.44 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -178.638 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 66.77 37.29 4.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.119 0.485 . . . . 0.0 111.393 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.467 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 27.3 mm-40 -118.18 137.81 52.74 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 177.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -93.15 125.04 37.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.946 0.403 . . . . 0.0 111.548 -178.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.414 HG22 HG23 ' A' ' 25' ' ' THR . 2.4 m -128.42 150.08 33.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.733 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 20.5 t -70.92 133.65 46.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.076 0.465 . . . . 0.0 111.41 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.7 t -144.59 161.53 38.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.464 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -143.1 157.91 44.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.396 0.617 . . . . 0.0 112.049 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.433 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.1 tp -137.08 128.56 42.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.142 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -88.23 116.78 26.67 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.949 HD22 HD22 ' A' ' 69' ' ' LEU . 4.6 mp -86.27 -14.44 43.72 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.544 178.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.406 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -56.19 -48.91 75.44 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.251 0.464 . . . . 0.0 112.251 -178.461 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.83 -10.48 39.63 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 122.014 -0.429 . . . . 0.0 111.56 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.427 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 32.2 m-70 -96.07 -64.5 1.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.588 HD12 ' N ' ' A' ' 41' ' ' ILE . 2.1 mp -80.26 148.51 5.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.276 178.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.559 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -141.15 171.63 13.8 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.784 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.624 HD22 ' HA2' ' A' ' 46' ' ' GLY . 27.1 t-20 -113.19 112.29 23.53 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.324 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.835 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.5 mp -112.97 89.28 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.141 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t0 68.43 37.02 2.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.252 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.624 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 85.95 0.28 87.43 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.425 179.146 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.3 m -109.81 135.02 51.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 117.254 0.527 . . . . 0.0 110.729 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.7 mt -77.31 116.56 18.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.838 0.828 . . . . 0.0 111.335 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.835 ' HB2' HD13 ' A' ' 44' ' ' ILE . 61.0 mttt -139.42 163.57 32.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.109 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.704 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.5 m-90 -87.83 127.82 35.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.091 0.472 . . . . 0.0 112.246 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.559 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 1.5 mt-30 -172.57 152.21 2.54 Favored Pre-proline 0 N--CA 1.467 0.385 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.896 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.3 62.21 2.68 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 121.86 1.707 . . . . 0.0 112.029 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.51 135.34 10.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.633 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.403 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.77 110.99 16.8 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -177.852 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.466 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 39.5 p90 -48.32 -29.63 4.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.512 178.264 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.0 p -49.02 -17.82 0.24 Allowed 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -179.376 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -63.01 -28.67 70.26 Favored 'General case' 0 C--N 1.332 -0.166 0 O-C-N 122.163 -0.336 . . . . 0.0 111.141 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.1 p -128.56 -0.05 5.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.522 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.3 m -111.47 148.73 32.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.316 0.579 . . . . 0.0 112.395 -178.539 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -143.3 157.86 44.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.132 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 63.64 45.34 4.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.013 0.435 . . . . 0.0 110.887 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.703 ' O ' HD22 ' A' ' 13' ' ' LEU . 74.9 m -70.33 137.26 50.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.828 179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.77 151.65 41.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.4 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.556 HG21 HD13 ' A' ' 19' ' ' LEU . 57.5 mt -130.58 141.18 46.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.353 0.597 . . . . 0.0 112.094 -179.62 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -137.0 109.05 7.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.318 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.412 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.38 -119.93 12.35 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.446 -0.883 . . . . 0.0 111.689 -178.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.45 ' HB3' HG21 ' A' ' 5' ' ' ILE . 25.8 p -100.69 -4.71 27.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.592 HG13 ' O ' ' A' ' 85' ' ' ILE . 11.0 t -103.18 140.59 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-O 121.041 0.448 . . . . 0.0 112.208 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.949 HD22 HD22 ' A' ' 37' ' ' LEU . 8.0 tp -103.37 126.93 50.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.516 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.483 ' N ' HD12 ' A' ' 69' ' ' LEU . 31.8 m -115.71 125.54 52.95 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 t -151.57 153.43 34.51 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.297 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 6.2 m -95.02 126.0 40.06 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.511 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 74.6 m -126.44 145.18 50.58 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -74.77 137.3 41.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.954 178.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 49.2 mtm180 -91.93 144.49 25.41 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.348 179.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.4 m -51.98 -27.03 11.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.579 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -82.85 1.55 38.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.354 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.96 137.82 7.4 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.314 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.75 -168.16 12.49 Favored Glycine 0 C--N 1.319 -0.386 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -178.606 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -133.7 143.32 48.44 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 117.379 0.59 . . . . 0.0 111.431 -179.532 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -154.14 131.28 11.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.185 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -93.48 134.46 35.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.612 -179.401 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.6 p -121.73 158.09 29.52 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.189 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 78.7 p -122.74 144.34 49.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.383 . . . . 0.0 111.136 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.687 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.8 tt -145.13 142.93 22.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.64 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -96.86 116.18 28.72 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.401 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.632 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 3.6 mt -96.71 -4.3 41.01 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -178.667 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.817 ' OD1' HG22 ' A' ' 5' ' ' ILE . 56.8 t30 -44.45 -26.91 0.39 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.461 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.0 m -81.86 -40.98 21.65 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.704 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.8 m -72.98 -52.64 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 113.485 0.921 . . . . 0.0 113.485 -177.907 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.519 ' N ' HG23 ' A' ' 90' ' ' VAL . 2.7 mp -81.83 147.57 6.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.042 0.448 . . . . 0.0 111.319 -179.201 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 20.0 tt0 -139.88 166.19 25.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.013 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -106.8 99.61 9.17 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-O 121.207 0.527 . . . . 0.0 110.349 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.8 t -98.46 98.0 6.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.616 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.489 ' O ' HG22 ' A' ' 25' ' ' THR . 31.7 t0 53.57 33.23 15.86 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.93 28.41 12.11 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.766 -0.731 . . . . 0.0 113.79 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.6 m -141.38 137.89 32.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.907 0.384 . . . . 0.0 111.108 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.433 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 67.8 mt -73.91 119.66 18.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.365 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 16.3 mttt -123.92 139.27 54.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.844 -178.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.427 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 20.3 t80 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.233 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.477 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 19.2 p90 . . . . . 0 N--CA 1.464 0.264 0 CA-C-O 120.641 0.257 . . . . 0.0 111.359 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.79 HG22 ' OD1' ' A' ' 88' ' ' ASN . 5.2 tp -68.12 -10.43 12.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 120.705 0.288 . . . . 0.0 111.469 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -77.28 -25.88 51.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.842 0.353 . . . . 0.0 110.798 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.3 p -118.31 -2.35 11.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.75 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.2 m -110.51 152.71 26.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.123 0.487 . . . . 0.0 111.143 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.406 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 1.2 ptm180 -132.87 172.84 12.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.606 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.408 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.4 p-10 50.13 56.97 7.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.951 0.405 . . . . 0.0 112.017 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.683 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.3 p -79.52 132.72 36.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.998 178.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.828 ' O ' HD12 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -157.19 163.3 39.0 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.281 -179.515 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.722 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.56 136.1 38.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.789 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.421 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.58 145.65 47.14 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.027 179.176 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.67 -153.4 29.11 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 119.731 -1.224 . . . . 0.0 111.196 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.2 -36.85 19.21 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.22 35.94 1.9 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 15.3 mp0 -116.67 147.66 41.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.088 0.471 . . . . 0.0 111.737 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.828 HD12 ' O ' ' A' ' 12' ' ' GLN . 13.6 tp -121.75 125.55 46.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.536 -0.756 . . . . 0.0 108.988 178.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.04 142.69 47.12 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.867 0.365 . . . . 0.0 110.104 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.11 172.17 17.25 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.118 -178.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -114.33 134.77 54.72 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 177.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 59.3 m -130.49 133.32 46.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.148 0.499 . . . . 0.0 111.693 -178.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 1.3 pttt -66.47 136.06 55.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.335 -179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 95' ' ' ASP . 46.0 p -84.51 -176.98 6.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.503 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.2 mmt180 -62.33 -29.79 70.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.145 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.74 9.78 7.29 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 66.77 37.29 4.24 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.144 0.497 . . . . 0.0 111.397 -178.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.477 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 28.2 mt-30 -118.51 137.47 53.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.088 178.241 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -94.23 126.5 39.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.898 0.38 . . . . 0.0 111.625 -178.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 25.6 m -131.04 153.0 38.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.051 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.9 m -73.16 134.11 44.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.12 0.486 . . . . 0.0 111.547 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.0 t -144.59 161.48 39.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.062 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.6 ttpt -141.4 156.84 45.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.454 0.645 . . . . 0.0 112.234 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.475 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -136.83 123.76 30.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 114.899 -1.046 . . . . 0.0 108.566 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -86.8 118.75 26.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.693 0.282 . . . . 0.0 110.673 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.798 HD11 ' CB ' ' A' ' 19' ' ' LEU . 4.3 mp -86.95 -14.98 40.22 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.491 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.1 p-10 -57.28 -43.73 83.36 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.288 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.1 p30 -91.8 -10.06 41.24 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 122.247 -0.283 . . . . 0.0 111.433 179.645 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.461 ' CD2' ' CD2' ' A' ' 100' ' ' TYR . 17.4 m80 -99.84 -64.19 1.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.614 HD11 HD22 ' A' ' 87' ' ' LEU . 26.0 mm -78.64 146.97 7.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.53 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.63 ' HB1' ' OG ' ' A' ' 53' ' ' SER . . . -139.56 172.01 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.611 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.496 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 26.7 t30 -112.74 108.25 17.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.824 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.2 mm -109.18 89.54 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.03 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.7 t70 68.3 39.54 2.27 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.138 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.3 0.71 90.04 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.903 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.8 m -110.61 137.2 48.6 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.845 0.355 . . . . 0.0 110.762 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.491 HD12 ' OG ' ' A' ' 83' ' ' SER . 11.5 mt -77.21 116.78 18.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.609 0.718 . . . . 0.0 111.281 -178.051 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -135.49 162.09 33.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.805 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.741 ' CE2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -86.21 121.55 28.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.993 0.425 . . . . 0.0 111.476 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.452 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 40.5 tt0 -174.17 150.36 1.56 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.38 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.452 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 7.3 Cg_exo -70.42 65.64 2.18 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.237 1.958 . . . . 0.0 112.369 -179.31 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.63 ' OG ' ' HB1' ' A' ' 42' ' ' ALA . 24.6 p -157.45 134.72 10.36 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.394 178.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.436 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.36 108.12 14.71 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -177.557 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.456 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 40.9 p90 -47.67 -30.69 3.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.22 178.267 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.6 p -47.26 -18.4 0.1 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.853 -179.459 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -65.08 -27.06 68.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.614 0.245 . . . . 0.0 111.535 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.496 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.5 p -129.22 -1.4 5.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.451 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -111.69 149.62 31.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.184 0.516 . . . . 0.0 111.916 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -142.19 157.58 44.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.735 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.4 m120 64.13 48.7 2.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.981 0.419 . . . . 0.0 110.657 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.722 ' O ' HD22 ' A' ' 13' ' ' LEU . 62.8 m -71.37 134.27 46.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.555 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.468 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -141.78 151.84 43.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.561 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.507 HG21 HD13 ' A' ' 19' ' ' LEU . 34.6 mt -130.4 141.52 46.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-O 121.353 0.597 . . . . 0.0 112.185 -179.786 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -137.74 109.0 6.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.887 178.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.17 -121.83 12.07 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.464 -0.874 . . . . 0.0 111.332 -178.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.42 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 31.2 p -102.47 -2.69 28.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.666 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.0 t -102.36 139.32 23.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.952 0.406 . . . . 0.0 111.592 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.792 HD22 HD22 ' A' ' 37' ' ' LEU . 6.3 tp -102.35 128.2 49.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.628 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.62 ' N ' HD12 ' A' ' 69' ' ' LEU . 4.2 m -116.8 123.92 48.29 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.1 t -151.63 153.28 34.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.608 0.242 . . . . 0.0 111.21 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.6 m -94.83 126.15 39.96 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.543 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.403 ' HB3' ' OD1' ' A' ' 43' ' ' ASN . 81.4 m -125.59 144.32 50.63 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.488 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -74.52 136.98 42.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.587 178.234 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -92.53 142.32 27.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.717 0.294 . . . . 0.0 110.583 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.1 m -52.13 -26.26 10.86 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.619 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -83.18 1.36 40.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.659 0.266 . . . . 0.0 111.532 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.13 133.42 6.53 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.804 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.83 -169.02 12.8 Favored Glycine 0 C--N 1.317 -0.483 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 -178.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -132.26 144.03 50.32 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 117.238 0.519 . . . . 0.0 111.413 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -154.11 129.98 10.17 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.558 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.4 t -91.82 134.67 34.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.41 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.491 ' OG ' HD12 ' A' ' 48' ' ' LEU . 29.7 p -123.42 158.04 32.06 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.402 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.0 m -122.45 145.53 48.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.02 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.677 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.9 tt -144.78 143.37 22.74 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.725 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -96.43 116.18 28.64 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.103 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.614 HD22 HD11 ' A' ' 41' ' ' ILE . 11.6 mt -96.95 -6.99 34.28 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -179.117 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.79 ' OD1' HG22 ' A' ' 5' ' ' ILE . 54.5 t30 -44.86 -28.19 0.62 Allowed 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -178.359 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.4 m -81.98 -38.23 25.46 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.741 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.9 m -74.4 -53.46 17.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -178.107 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.611 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.2 147.63 5.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.06 0.457 . . . . 0.0 111.268 -178.942 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 9.9 tt0 -137.32 166.54 23.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.157 -178.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -107.21 99.42 8.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.121 0.486 . . . . 0.0 110.184 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.1 t -98.28 96.08 4.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.196 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.514 ' O ' HG22 ' A' ' 25' ' ' THR . 28.3 t0 53.09 33.47 15.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.655 0.264 . . . . 0.0 111.466 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.59 28.65 12.17 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.269 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 62.5 p -140.92 133.76 29.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.802 0.334 . . . . 0.0 110.912 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.437 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 77.4 mt -74.49 121.07 20.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.732 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.458 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 8.5 mttm -125.11 137.0 54.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.076 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.461 ' CD2' ' CD2' ' A' ' 40' ' ' HIS . 39.1 t80 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.649 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.454 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 14.1 p90 . . . . . 0 N--CA 1.464 0.266 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.743 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.0 tp -63.87 -19.33 24.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.633 0.254 . . . . 0.0 111.446 -179.33 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -75.45 -26.79 58.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.819 0.342 . . . . 0.0 110.855 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.7 p -118.66 13.95 13.43 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.537 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 71.1 m -127.11 153.6 45.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.037 0.446 . . . . 0.0 111.477 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -133.1 172.58 12.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.96 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.0 p30 49.62 57.66 6.27 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.713 HG21 ' CD1' ' A' ' 5' ' ' ILE . 31.3 p -79.65 134.15 36.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.015 178.095 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.7 ' O ' HD12 ' A' ' 19' ' ' LEU . 17.9 pt20 -158.86 163.84 36.26 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.132 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.745 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.39 136.22 38.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.177 0.513 . . . . 0.0 110.991 -179.779 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.74 145.01 46.93 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.381 179.097 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.62 -152.38 30.95 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.55 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -85.89 -37.14 19.45 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.224 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.11 35.54 1.54 Allowed 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 5.8 mp0 -114.34 146.91 39.93 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.927 0.394 . . . . 0.0 111.48 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.766 ' CB ' HD11 ' A' ' 37' ' ' LEU . 14.0 tp -120.3 124.49 45.72 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.183 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.409 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . . . -121.74 144.55 48.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.94 0.4 . . . . 0.0 110.048 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.79 172.8 15.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.089 -178.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -109.78 133.98 52.53 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.426 ' SG ' HD21 ' A' ' 98' ' ' LEU . 83.0 m -130.67 134.11 46.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.191 0.52 . . . . 0.0 112.139 -178.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.6 ptpt -66.43 137.3 56.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.506 -179.573 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 95' ' ' ASP . 72.8 p -86.06 -179.52 6.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.447 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -60.36 -29.87 69.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.655 0.264 . . . . 0.0 111.134 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.66 10.39 9.38 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 66.88 39.74 3.29 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.207 0.527 . . . . 0.0 112.052 -179.23 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.432 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 68.1 mt-30 -119.96 136.03 54.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.403 -0.817 . . . . 0.0 108.853 177.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.402 ' CE1' ' HB3' ' A' ' 24' ' ' LYS . 63.7 m-85 -92.09 126.39 37.15 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.023 0.439 . . . . 0.0 111.958 -178.372 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 29.3 m -131.09 152.49 37.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.163 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.3 t -72.96 134.39 44.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.135 0.493 . . . . 0.0 111.667 -179.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 t -145.76 161.57 39.62 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.362 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.409 ' HG3' ' HB2' ' A' ' 20' ' ' ALA . 20.2 ttpt -144.04 157.17 44.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.353 0.597 . . . . 0.0 112.139 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.412 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -135.21 129.4 50.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.834 179.498 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -88.52 116.44 26.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.558 0.218 . . . . 0.0 111.414 -178.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.806 HD22 HD22 ' A' ' 69' ' ' LEU . 4.2 mp -87.58 -15.91 36.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.325 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -47.28 73.44 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -178.439 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.415 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 3.2 m-20 -92.26 -10.33 38.9 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 122.169 -0.332 . . . . 0.0 111.755 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.434 ' HB3' HD12 ' A' ' 41' ' ' ILE . 21.7 m-70 -96.29 -64.9 1.01 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.789 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.63 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.9 mp -82.53 147.71 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.419 178.871 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -141.3 171.99 13.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.815 -0.629 . . . . 0.0 112.081 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.633 HD22 ' HA2' ' A' ' 46' ' ' GLY . 26.1 t-20 -112.87 113.21 25.18 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.941 -179.291 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.806 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.5 mp -113.59 89.49 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.937 0.399 . . . . 0.0 111.141 179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 50.1 t0 69.77 37.26 1.88 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.449 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.633 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 86.03 0.75 87.11 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.643 -0.789 . . . . 0.0 113.293 179.244 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 39.8 m -112.84 135.97 53.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 117.198 0.499 . . . . 0.0 110.8 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.444 HD12 ' OG ' ' A' ' 83' ' ' SER . 18.8 mt -77.18 117.19 18.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.635 0.731 . . . . 0.0 111.733 -177.706 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.806 ' HB2' HD13 ' A' ' 44' ' ' ILE . 30.0 mmtt -137.82 162.86 32.84 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.641 179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.875 ' CH2' HD11 ' A' ' 85' ' ' ILE . 3.6 m-90 -86.51 125.06 33.49 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.031 0.443 . . . . 0.0 111.99 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.404 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 12.2 tt0 -175.85 149.09 1.01 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.917 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.415 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 7.7 Cg_exo -69.04 66.75 1.34 Allowed 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.981 1.788 . . . . 0.0 112.061 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -156.81 131.38 8.74 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.184 179.096 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.68 109.36 15.15 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.258 0.552 . . . . 0.0 112.245 -177.635 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 41.1 p90 -48.15 -31.23 5.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.723 178.894 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.5 p -49.69 -18.28 0.44 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.676 -179.274 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -62.06 -30.18 70.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.597 0.237 . . . . 0.0 111.013 -179.056 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.0 p -126.74 -3.39 6.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.289 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.2 m -108.14 148.99 29.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.216 0.532 . . . . 0.0 112.118 -178.594 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.8 p90 -142.96 157.67 44.34 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.053 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 63.36 44.11 5.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.007 0.432 . . . . 0.0 110.728 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.745 ' O ' HD22 ' A' ' 13' ' ' LEU . 73.3 m -68.58 136.63 53.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.618 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.417 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.47 152.1 42.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.508 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.47 HG21 HD13 ' A' ' 19' ' ' LEU . 39.4 mt -129.01 139.68 51.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.238 0.542 . . . . 0.0 111.866 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -134.12 107.86 7.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.44 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.99 -120.19 13.4 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.4 -0.905 . . . . 0.0 111.3 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.3 p -99.88 -4.04 31.17 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.492 HG13 ' O ' ' A' ' 85' ' ' ILE . 12.6 t -103.15 140.09 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.806 HD22 HD22 ' A' ' 37' ' ' LEU . 8.5 tp -103.16 125.57 49.92 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.573 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.454 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -115.3 125.74 53.64 Favored 'General case' 0 N--CA 1.461 0.108 0 N-CA-C 110.094 -0.335 . . . . 0.0 110.094 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.3 t -151.86 153.59 34.5 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.69 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 10.7 m -95.53 126.12 40.59 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.453 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.493 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 70.8 m -127.45 146.7 50.4 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -178.275 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -75.27 137.1 40.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.108 178.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 30.5 mtm180 -91.98 143.98 25.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.19 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 14.2 m -51.83 -27.17 11.64 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -179.025 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -82.39 1.81 35.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.694 0.283 . . . . 0.0 111.436 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.92 136.04 7.54 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.817 179.757 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.18 -166.85 12.23 Favored Glycine 0 C--N 1.319 -0.362 0 N-CA-C 111.658 -0.577 . . . . 0.0 111.658 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -133.32 143.09 48.79 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.979 0.419 . . . . 0.0 111.163 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -154.3 132.95 12.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.119 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.3 t -94.22 134.38 36.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.842 0.353 . . . . 0.0 111.656 -179.473 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.444 ' OG ' HD12 ' A' ' 48' ' ' LEU . 23.5 p -119.8 157.76 27.96 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.192 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.7 m -121.44 142.38 50.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.916 0.389 . . . . 0.0 111.088 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.875 HD11 ' CH2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -147.78 144.51 19.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.613 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.753 ' N ' HD13 ' A' ' 85' ' ' ILE . 15.0 t0 -101.05 121.33 41.61 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.285 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.733 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 2.3 mt -100.66 -3.22 30.77 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -179.405 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.743 ' OD1' HG22 ' A' ' 5' ' ' ILE . 35.5 t30 -45.3 -26.92 0.58 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.706 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.91 -42.12 24.77 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.666 HG11 ' CE2' ' A' ' 50' ' ' TRP . 4.1 m -72.63 -51.32 28.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -177.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.513 ' N ' HG23 ' A' ' 90' ' ' VAL . 2.7 mp -81.78 147.3 6.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.037 0.446 . . . . 0.0 111.347 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 99' ' ' LYS . 3.9 tt0 -138.62 166.8 23.42 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.972 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -107.69 99.93 9.37 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.191 0.52 . . . . 0.0 110.855 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.3 t -98.89 97.14 5.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.13 179.218 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.476 ' O ' HG22 ' A' ' 25' ' ' THR . 25.8 t0 53.79 33.13 16.24 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.7 28.4 12.53 Favored Glycine 0 CA--C 1.518 0.271 0 C-N-CA 120.585 -0.817 . . . . 0.0 113.206 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.9 m -141.41 135.48 30.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.867 0.365 . . . . 0.0 111.318 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.426 HD21 ' SG ' ' A' ' 23' ' ' CYS . 28.1 mt -74.39 119.4 18.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.44 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.404 ' O ' ' N ' ' A' ' 92' ' ' GLU . 0.3 OUTLIER -125.31 135.64 52.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.321 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 8.5 t80 . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.678 178.799 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.1 p90 . . . . . 0 N--CA 1.464 0.241 0 CA-C-O 120.706 0.289 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.799 HG22 ' OD1' ' A' ' 88' ' ' ASN . 4.4 tp -62.48 -21.11 26.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.389 -179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -72.15 -24.28 61.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.744 0.307 . . . . 0.0 110.598 179.056 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.6 p -119.09 -3.99 10.6 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 86.3 m -107.19 152.07 24.56 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.811 0.339 . . . . 0.0 111.188 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -131.65 173.25 11.32 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.719 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 47.1 57.73 5.46 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.78 HG21 ' CD1' ' A' ' 5' ' ' ILE . 82.1 p -78.82 132.46 36.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.872 178.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.716 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.0 pt20 -158.57 164.34 36.17 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.959 0.409 . . . . 0.0 111.667 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.645 HD22 ' O ' ' A' ' 62' ' ' SER . 0.9 OUTLIER -97.5 135.8 38.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.497 -179.315 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.13 145.1 46.25 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.257 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 56.64 -150.27 27.16 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.318 -0.944 . . . . 0.0 111.425 -178.444 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.35 -37.82 18.08 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.789 0.662 . . . . 0.0 112.789 -178.106 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.449 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.9 p -141.17 37.1 1.73 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -114.66 148.75 37.74 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.943 0.401 . . . . 0.0 111.869 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.813 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.1 tp -121.89 122.35 39.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.191 179.198 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.73 143.43 46.22 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.38 172.68 16.13 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -113.63 133.36 55.34 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.555 ' SG ' HD21 ' A' ' 98' ' ' LEU . 54.7 m -130.47 132.78 45.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.148 0.499 . . . . 0.0 111.519 -178.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -64.84 137.95 58.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.671 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.403 HG22 ' O ' ' A' ' 95' ' ' ASP . 52.6 p -86.6 -177.42 6.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.771 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.8 mtp85 -61.48 -29.36 69.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.028 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.43 8.84 12.59 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 67.04 36.83 4.02 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.163 0.506 . . . . 0.0 111.274 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -117.07 134.53 54.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -90.99 124.92 35.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.119 0.485 . . . . 0.0 111.817 -178.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.6 m -130.16 150.86 35.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.635 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.7 t -72.03 136.57 46.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.345 0.593 . . . . 0.0 111.776 -178.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.7 t -145.34 162.35 37.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.212 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.414 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.9 OUTLIER -144.7 156.1 43.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.537 0.685 . . . . 0.0 111.92 -179.172 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.513 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -135.38 126.8 45.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.633 179.173 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -87.58 114.65 24.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.703 0.287 . . . . 0.0 110.807 -178.111 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.891 HD22 HD22 ' A' ' 69' ' ' LEU . 3.6 mp -86.15 -15.51 40.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.952 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -46.04 78.29 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.631 -0.428 . . . . 0.0 111.591 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.55 -10.2 41.49 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.45 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 30.3 m-70 -96.61 -60.34 1.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.525 HD13 ' CD1' ' A' ' 50' ' ' TRP . 32.8 mm -81.03 146.75 6.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.571 178.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.409 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -139.56 170.14 16.45 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.395 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.68 HD22 ' HA2' ' A' ' 46' ' ' GLY . 23.1 t-20 -111.92 108.69 18.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.86 -179.249 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 48.2 mm -108.51 88.76 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.791 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 53.8 t0 66.43 39.42 3.94 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.827 0.346 . . . . 0.0 111.563 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.68 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 83.78 0.38 89.79 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 121.007 -0.616 . . . . 0.0 113.404 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.0 m -109.02 136.33 48.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 117.009 0.405 . . . . 0.0 110.958 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.479 HD22 HG21 ' A' ' 41' ' ' ILE . 12.6 mt -77.57 117.03 18.61 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.519 0.676 . . . . 0.0 111.408 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.7 mmtt -138.39 163.51 31.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.607 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.795 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 7.4 m-90 -84.77 124.27 31.37 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.976 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.05 146.78 1.43 Allowed Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.848 -178.625 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -70.56 65.62 2.26 Favored 'Trans proline' 0 C--N 1.358 1.044 0 C-N-CA 122.464 2.11 . . . . 0.0 111.571 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.409 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.1 p -159.62 132.11 6.61 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.467 -1.242 . . . . 0.0 107.998 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.57 109.69 15.34 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -177.616 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.449 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.0 p90 -48.64 -30.31 5.3 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.974 177.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 35.4 p -49.92 -18.76 0.56 Allowed 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -63.1 -26.43 68.83 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.818 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.9 p -129.76 0.72 4.88 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.302 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.5 m -111.84 148.16 34.21 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.321 0.582 . . . . 0.0 112.268 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 35.5 p90 -141.7 157.99 44.37 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.528 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 64.3 42.56 5.25 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.838 0.351 . . . . 0.0 110.959 -179.598 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.645 ' O ' HD22 ' A' ' 13' ' ' LEU . 55.0 m -68.57 137.88 54.66 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.498 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.84 150.99 39.32 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.878 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.48 HG13 ' HB2' ' A' ' 13' ' ' LEU . 21.4 mt -129.09 140.24 49.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.47 0.652 . . . . 0.0 112.34 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -137.84 108.85 6.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.036 179.293 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.413 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 69.59 -122.64 12.44 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.322 -0.942 . . . . 0.0 111.145 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.405 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 24.6 p -100.91 -5.46 26.0 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.491 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 85' ' ' ILE . 3.2 t -101.1 140.77 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 120.995 0.426 . . . . 0.0 111.845 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.891 HD22 HD22 ' A' ' 37' ' ' LEU . 9.0 tp -104.28 127.61 51.94 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.655 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.469 ' N ' HD12 ' A' ' 69' ' ' LEU . 6.0 m -116.28 123.81 48.61 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.865 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.3 t -151.47 153.28 34.33 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.242 -0.183 . . . . 0.0 111.304 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.5 m -95.45 126.11 40.52 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.498 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 72.7 m -125.8 145.16 50.34 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -75.78 136.84 40.26 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.598 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 45.3 mtm180 -91.78 146.19 23.96 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.634 0.254 . . . . 0.0 110.693 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.4 m -52.25 -30.39 27.47 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -82.26 1.52 36.33 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.481 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.43 137.04 6.75 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.481 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 118.45 -176.43 16.11 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -127.73 141.58 51.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.576 0.688 . . . . 0.0 110.903 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -153.84 128.8 9.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.015 0.436 . . . . 0.0 110.665 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -92.18 135.48 33.96 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.894 -179.325 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.3 p -122.46 158.22 30.24 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.102 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 58.2 m -124.95 146.26 49.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.882 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.795 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 12.2 tt -146.34 143.69 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.769 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -95.41 119.72 34.39 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.386 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.562 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 7.1 mt -100.23 -5.81 27.0 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.581 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.799 ' OD1' HG22 ' A' ' 5' ' ' ILE . 58.4 t30 -44.5 -29.1 0.66 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.427 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.13 -38.37 27.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.726 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -74.42 -52.43 19.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -178.017 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.608 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -82.81 146.37 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-O 120.859 0.362 . . . . 0.0 111.866 -178.689 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.405 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 21.4 tt0 -135.75 164.04 28.8 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.223 -178.655 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -107.05 99.75 9.28 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.38 0.61 . . . . 0.0 111.019 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 52.4 t -97.02 97.07 5.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.867 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.403 ' O ' HG22 ' A' ' 25' ' ' THR . 15.1 t0 51.65 33.3 10.57 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.03 28.75 9.63 Favored Glycine 0 C--N 1.329 0.168 0 C-N-CA 120.444 -0.884 . . . . 0.0 113.104 178.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 69.8 m -142.07 135.21 28.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.89 0.376 . . . . 0.0 111.035 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.555 HD21 ' SG ' ' A' ' 23' ' ' CYS . 44.5 mt -75.11 121.89 22.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.192 -179.483 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.1 mttm -126.59 134.35 50.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.118 0.485 . . . . 0.0 112.178 -179.078 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.45 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 10.1 t80 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.43 179.333 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.434 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 16.0 p90 . . . . . 0 N--CA 1.467 0.38 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.781 ' CD1' HG21 ' A' ' 11' ' ' THR . 8.2 tp -61.41 -20.73 23.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -74.12 -25.28 59.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.311 179.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.5 p -118.75 -5.95 10.63 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.667 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 66.3 m -104.91 152.77 22.24 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.08 0.467 . . . . 0.0 111.122 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -132.18 172.86 11.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.963 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 47.33 58.33 4.98 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.015 0.436 . . . . 0.0 111.721 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.781 HG21 ' CD1' ' A' ' 5' ' ' ILE . 54.4 p -79.11 130.27 35.33 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.664 178.639 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.649 ' O ' HD12 ' A' ' 19' ' ' LEU . 18.0 pt20 -156.67 164.13 38.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.778 -178.612 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.7 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.45 136.89 37.23 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.918 -179.902 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.82 144.23 48.45 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 60.27 -152.63 36.95 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 119.818 -1.182 . . . . 0.0 111.589 -179.175 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.7 m -86.64 -36.32 18.85 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.43 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.9 p -142.65 34.67 1.43 Allowed 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -178.697 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -113.51 151.22 31.82 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.957 0.408 . . . . 0.0 112.081 178.142 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.825 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.4 tp -124.85 124.88 43.02 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.185 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.411 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . . . -120.55 143.34 48.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.69 172.74 15.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.176 -178.309 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -114.43 133.94 55.36 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 32.3 m -130.74 132.98 45.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.114 0.483 . . . . 0.0 111.877 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 10.6 ptpt -65.74 137.83 57.53 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.435 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 95' ' ' ASP . 54.7 p -85.16 -176.31 6.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.575 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -62.34 -30.12 70.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.915 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.51 9.02 10.1 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 66.95 37.9 3.77 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.035 0.445 . . . . 0.0 111.806 -178.812 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.402 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 9.2 mt-30 -118.77 135.66 54.39 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 177.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -90.6 124.98 35.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.921 0.391 . . . . 0.0 111.995 -178.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.9 m -129.79 148.54 33.21 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.755 179.398 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.3 m -70.25 135.1 48.67 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.22 0.533 . . . . 0.0 111.959 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -144.62 161.81 38.22 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.344 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.411 ' HG3' ' HB2' ' A' ' 20' ' ' ALA . 28.7 ttpt -142.92 157.43 44.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.531 0.682 . . . . 0.0 112.333 -179.017 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.448 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -137.12 126.84 37.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.039 179.826 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -88.47 115.0 25.67 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.886 0.374 . . . . 0.0 111.535 -178.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.825 HD11 ' CB ' ' A' ' 19' ' ' LEU . 2.8 mp -85.66 -16.42 39.18 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.543 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.403 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -55.84 -48.15 75.99 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.637 0.256 . . . . 0.0 111.214 -179.047 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.403 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.2 OUTLIER -91.47 -10.43 40.89 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.736 -0.386 . . . . 0.0 111.594 179.515 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -95.05 -66.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.818 HD12 HD23 ' A' ' 37' ' ' LEU . 45.3 mt -79.85 151.19 4.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.747 178.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.35 172.28 12.91 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.029 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.635 HD22 ' HA2' ' A' ' 46' ' ' GLY . 21.6 t-20 -109.2 109.68 20.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.809 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 44.7 mm -110.7 88.93 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.637 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.7 t70 68.15 39.84 2.31 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.604 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.635 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 83.15 1.14 90.52 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 120.625 -0.798 . . . . 0.0 113.094 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.3 m -112.54 137.05 51.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.88 0.371 . . . . 0.0 110.953 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 52.1 mt -76.66 116.07 17.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.548 0.69 . . . . 0.0 110.58 -178.414 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -135.18 161.96 33.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.609 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.74 ' CE2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -87.78 120.89 29.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.991 0.424 . . . . 0.0 111.512 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.435 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 20.2 tt0 -175.25 143.73 0.76 Allowed Pre-proline 0 N--CA 1.465 0.28 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.823 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.435 ' HD2' ' HG3' ' A' ' 51' ' ' GLN . 33.6 Cg_endo -64.25 75.71 0.18 Allowed 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 121.983 1.789 . . . . 0.0 112.91 -179.008 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -165.68 133.5 2.98 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.332 179.126 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.07 110.0 16.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.231 0.539 . . . . 0.0 112.151 -178.022 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.2 p90 -49.58 -29.16 6.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.573 178.451 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 61.5 p -49.6 -17.7 0.35 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -62.51 -28.14 69.64 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.595 0.235 . . . . 0.0 111.216 -179.117 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.4 p -129.84 -1.25 4.76 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.9 m -109.49 147.62 32.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.332 0.587 . . . . 0.0 112.482 -178.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -142.92 158.52 43.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.605 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 64.31 43.53 4.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.858 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.7 ' O ' HD22 ' A' ' 13' ' ' LEU . 74.3 m -68.64 137.06 53.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.931 179.646 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.436 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -144.0 152.93 41.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.291 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.498 ' CG1' HD13 ' A' ' 69' ' ' LEU . 43.5 mt -130.47 140.87 47.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.254 0.549 . . . . 0.0 111.717 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -137.17 107.96 6.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.668 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.71 -122.29 11.84 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.615 -0.802 . . . . 0.0 111.631 -178.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.5 p -101.08 -5.33 25.87 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.345 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.47 HG13 ' O ' ' A' ' 85' ' ' ILE . 10.6 t -101.41 139.56 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 120.882 0.372 . . . . 0.0 111.672 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.759 HD22 HD22 ' A' ' 37' ' ' LEU . 9.8 tp -101.67 127.73 48.29 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.675 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.477 ' N ' HD12 ' A' ' 69' ' ' LEU . 7.2 m -116.75 123.12 46.39 Favored 'General case' 0 N--CA 1.461 0.099 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.1 t -151.96 153.99 35.17 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.748 -178.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.5 m -94.34 125.66 39.12 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 178.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.481 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 88.4 m -125.61 142.87 51.28 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.228 0.537 . . . . 0.0 112.445 -178.777 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -74.46 138.5 43.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.728 178.206 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.5 mtp180 -91.43 144.56 25.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.629 0.252 . . . . 0.0 110.629 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 24.6 m -52.62 -27.65 17.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.326 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.16 2.45 31.45 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.678 0.275 . . . . 0.0 111.208 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.78 136.46 6.7 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.726 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.59 -170.24 13.22 Favored Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 111.245 -0.742 . . . . 0.0 111.245 -178.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -130.73 142.36 50.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 117.23 0.515 . . . . 0.0 111.226 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -154.0 130.15 10.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.459 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.4 t -93.39 134.9 35.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.037 0.446 . . . . 0.0 111.743 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 89.7 p -122.22 158.49 29.33 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.344 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.4 m -122.76 146.05 47.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.823 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.725 HD11 ' CH2' ' A' ' 50' ' ' TRP . 9.7 tt -147.76 143.46 19.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.037 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -97.07 119.82 36.27 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.684 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.535 ' HB3' HD12 ' A' ' 91' ' ' ILE . 9.4 mt -100.71 -6.41 25.08 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -178.548 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.778 ' OD1' HG22 ' A' ' 5' ' ' ILE . 41.9 t30 -45.09 -29.72 0.95 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -178.608 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.3 t -81.28 -39.45 25.21 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.74 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.8 m -72.68 -52.1 24.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.632 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.85 147.33 6.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 0.0 110.764 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -138.49 165.94 25.55 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.097 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 29.0 t30 -106.59 99.7 9.26 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.221 0.534 . . . . 0.0 110.27 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -98.54 95.32 4.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.885 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.48 ' O ' HG22 ' A' ' 25' ' ' THR . 33.9 t0 52.13 32.61 10.76 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.573 0.225 . . . . 0.0 111.58 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.78 28.56 10.05 Favored Glycine 0 C--N 1.329 0.155 0 C-N-CA 120.593 -0.813 . . . . 0.0 113.635 178.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.1 m -141.65 134.33 28.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.932 0.366 . . . . 0.0 110.632 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.425 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 82.6 mt -73.26 120.6 19.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.678 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.407 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 11.7 mttt -125.91 141.07 52.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.136 0.493 . . . . 0.0 112.276 -178.585 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 22.6 t80 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.31 179.38 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.44 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 18.5 p90 . . . . . 0 CA--C 1.53 0.201 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.771 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.0 tp -63.4 -18.16 21.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.728 0.299 . . . . 0.0 111.495 -179.655 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -74.8 -24.31 58.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.978 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.1 p -118.71 15.1 13.57 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.649 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 56.5 m -131.47 154.09 49.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.171 0.51 . . . . 0.0 111.304 -179.655 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.4 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 6.3 ptt180 -132.76 173.19 11.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.676 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.419 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.7 p-10 48.95 56.71 7.34 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.648 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.0 p -79.37 133.75 36.59 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.565 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.677 ' O ' HD12 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -158.09 164.21 36.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.845 -178.911 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.714 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.41 136.35 37.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.994 -179.859 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.5 144.62 46.91 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.454 -0.794 . . . . 0.0 108.993 178.977 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.15 -152.16 29.45 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.847 -1.168 . . . . 0.0 111.846 -179.09 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.73 -36.7 20.01 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.343 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -142.53 35.92 1.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.8 mp0 -114.5 147.53 39.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.199 0.523 . . . . 0.0 111.689 179.09 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.768 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.3 tp -120.93 123.99 43.84 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.394 179.287 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.572 ' HB2' ' HE2' ' A' ' 34' ' ' LYS . . . -121.42 142.98 49.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.961 0.41 . . . . 0.0 110.105 179.712 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.59 172.64 16.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.945 -178.788 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -111.82 133.73 53.84 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 176.841 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.3 m -130.61 133.95 46.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.072 0.463 . . . . 0.0 111.66 -178.966 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 8.1 ptpt -67.11 137.49 56.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.704 -179.479 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.511 HG22 ' O ' ' A' ' 95' ' ' ASP . 72.1 p -85.59 -179.19 6.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.402 179.772 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -60.63 -29.77 69.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.659 0.266 . . . . 0.0 111.12 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.58 9.36 9.56 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -178.948 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 67.04 38.52 3.46 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.146 0.498 . . . . 0.0 111.911 -179.014 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.402 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 12.6 mm100 -119.53 134.95 54.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.515 -0.766 . . . . 0.0 108.968 178.06 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -92.25 124.94 36.69 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.025 0.44 . . . . 0.0 111.821 -178.62 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.2 m -129.87 150.46 34.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.735 179.667 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.8 p -71.25 134.4 46.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.239 0.542 . . . . 0.0 111.725 -178.737 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.3 t -142.74 161.86 36.97 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.295 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.572 ' HE2' ' HB2' ' A' ' 20' ' ' ALA . 17.6 ttmt -143.67 156.18 44.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.481 0.658 . . . . 0.0 112.187 -179.07 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.588 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -136.53 124.94 35.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 114.998 -1.001 . . . . 0.0 108.501 179.142 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -88.24 119.02 28.24 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.709 0.29 . . . . 0.0 111.294 -177.973 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.829 HD22 HD22 ' A' ' 69' ' ' LEU . 4.0 mp -89.04 -14.72 35.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.808 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.0 p-10 -57.87 -43.44 85.99 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.754 -178.467 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.423 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.5 OUTLIER -92.77 -10.52 36.64 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.944 -0.472 . . . . 0.0 111.611 178.691 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -97.98 -64.2 1.06 Allowed 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.913 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.668 HD11 HD22 ' A' ' 87' ' ' LEU . 31.5 mm -80.07 145.73 8.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.444 178.764 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.457 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -137.92 171.46 14.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.5 -179.811 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.549 ' C ' HD12 ' A' ' 44' ' ' ILE . 20.2 t30 -113.12 111.71 22.58 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.251 -178.968 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.761 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.2 mp -112.7 95.03 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.394 179.192 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.3 t0 64.12 38.06 8.6 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.078 -179.561 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.08 11.63 82.17 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.218 179.374 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.7 m -120.4 136.49 54.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.024 0.412 . . . . 0.0 110.721 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.59 HD22 HG21 ' A' ' 41' ' ' ILE . 25.6 mt -77.42 118.1 19.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.559 0.695 . . . . 0.0 111.624 -177.976 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.761 ' HB2' HD13 ' A' ' 44' ' ' ILE . 25.6 mttt -139.15 163.42 32.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.006 -179.916 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.822 ' CH2' HD11 ' A' ' 85' ' ' ILE . 4.8 m-90 -85.4 119.0 25.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.956 0.408 . . . . 0.0 111.78 -179.413 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.457 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 18.0 mt-30 -169.4 151.45 4.51 Favored Pre-proline 0 N--CA 1.468 0.425 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.5 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.75 60.82 2.91 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 121.975 1.783 . . . . 0.0 112.394 -179.744 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.7 p -153.43 135.75 14.96 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.442 -0.799 . . . . 0.0 108.89 179.123 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -81.03 113.06 18.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -177.95 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.424 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 48.5 p90 -52.57 -33.49 46.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.414 178.316 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 60.1 p -48.97 -21.29 0.64 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.702 -179.11 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -62.0 -25.26 67.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.62 0.248 . . . . 0.0 110.898 -179.278 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.418 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -127.71 -2.24 6.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.127 178.797 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.8 m -111.09 148.36 32.83 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.25 0.548 . . . . 0.0 112.369 -178.277 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 41.3 p90 -140.12 157.33 45.8 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.053 179.538 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 41.1 m-20 62.99 45.15 5.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.059 0.457 . . . . 0.0 110.444 -178.989 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.714 ' O ' HD22 ' A' ' 13' ' ' LEU . 67.3 m -70.04 136.54 50.44 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.658 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.44 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -143.57 154.0 43.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.134 -179.618 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.522 HD13 HD13 ' A' ' 19' ' ' LEU . 47.0 mt -130.8 140.12 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.59 179.526 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -134.76 108.68 8.1 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.159 -0.928 . . . . 0.0 108.549 178.908 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.9 -119.68 11.26 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.327 -0.939 . . . . 0.0 111.193 -178.203 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.417 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 26.7 p -102.83 -3.49 26.24 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.411 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.53 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.3 t -101.55 137.58 28.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.93 0.395 . . . . 0.0 111.844 -179.835 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.829 HD22 HD22 ' A' ' 37' ' ' LEU . 9.3 tp -101.03 124.79 47.29 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.781 179.536 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.4 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.6 m -114.87 126.77 55.19 Favored 'General case' 0 CA--C 1.521 -0.144 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.349 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 t -151.68 153.62 34.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.73 0.3 . . . . 0.0 111.282 -179.127 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.6 m -94.3 125.61 39.04 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.703 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 85.9 m -128.55 147.2 50.69 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.44 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -75.48 136.79 40.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.179 178.505 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -91.7 144.05 25.92 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 179.282 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.3 m -52.19 -28.58 18.79 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.053 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -80.8 2.2 27.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.676 0.274 . . . . 0.0 111.504 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.03 135.06 6.7 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.561 179.99 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.5 -168.72 12.99 Favored Glycine 0 C--N 1.318 -0.442 0 N-CA-C 111.612 -0.595 . . . . 0.0 111.612 -179.0 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -131.2 141.14 50.01 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.877 0.339 . . . . 0.0 110.992 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -154.6 132.66 11.68 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.653 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -94.44 134.55 36.84 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.784 -179.367 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.5 p -121.46 157.99 29.38 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.897 0.38 . . . . 0.0 110.63 179.696 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 8.1 p -120.76 143.92 48.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.328 -179.511 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.822 HD11 ' CH2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -146.83 145.5 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.333 179.563 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.777 ' N ' HD13 ' A' ' 85' ' ' ILE . 21.0 t0 -101.5 121.54 42.15 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.422 -179.479 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.668 HD22 HD11 ' A' ' 41' ' ' ILE . 4.3 mt -103.46 -2.88 26.16 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -178.897 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.771 ' OD1' HG22 ' A' ' 5' ' ' ILE . 52.9 t30 -44.87 -27.31 0.51 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.388 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.4 m -81.37 -39.13 25.49 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.64 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.644 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.7 m -75.3 -52.45 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -177.668 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.506 ' N ' HG23 ' A' ' 90' ' ' VAL . 2.6 mp -80.52 145.57 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.895 0.378 . . . . 0.0 110.969 -179.148 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -136.84 165.97 24.71 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.343 -178.476 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -105.9 99.28 8.88 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.116 0.484 . . . . 0.0 110.34 179.999 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.505 HG11 ' HE3' ' A' ' 99' ' ' LYS . 38.2 t -98.59 95.49 4.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.108 179.564 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.511 ' O ' HG22 ' A' ' 25' ' ' THR . 24.7 t0 55.35 31.88 17.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.626 0.251 . . . . 0.0 111.559 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.07 28.21 12.29 Favored Glycine 0 C--N 1.329 0.158 0 C-N-CA 120.745 -0.74 . . . . 0.0 113.156 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 74.0 m -140.3 135.09 31.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.757 0.313 . . . . 0.0 110.801 179.776 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 66.6 mt -73.48 121.19 20.16 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.085 -179.652 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.505 ' HE3' HG11 ' A' ' 94' ' ' VAL . 17.0 mttt -124.78 126.3 45.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.07 0.462 . . . . 0.0 111.572 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.414 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 56.0 t80 . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.637 179.837 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.475 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 17.5 p90 . . . . . 0 N--CA 1.465 0.299 0 CA-C-O 120.646 0.26 . . . . 0.0 111.584 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.796 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.2 tp -65.45 -14.68 17.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.68 0.276 . . . . 0.0 111.631 -179.447 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -74.91 -24.64 58.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.819 0.342 . . . . 0.0 110.717 179.424 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.4 p -118.65 -2.77 10.91 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.495 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 68.0 m -108.88 150.3 27.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.084 0.469 . . . . 0.0 111.236 -179.526 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.429 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.4 ptm180 -132.18 172.52 12.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.779 -179.861 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.429 ' OD1' ' O ' ' A' ' 9' ' ' ARG . 5.7 p-10 48.71 58.26 5.47 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.908 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.714 HG21 ' CD1' ' A' ' 5' ' ' ILE . 42.6 p -79.25 132.15 36.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.75 178.65 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.707 ' O ' HD12 ' A' ' 19' ' ' LEU . 13.4 pt20 -156.13 163.28 39.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.253 -179.228 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.752 HD22 ' O ' ' A' ' 62' ' ' SER . 0.8 OUTLIER -97.65 135.7 39.09 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.903 -179.754 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.54 144.31 48.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.12 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.07 -153.07 31.45 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.764 -1.208 . . . . 0.0 111.321 -178.761 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.55 -37.24 19.83 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -178.243 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.461 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.92 36.67 1.59 Allowed 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.201 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.1 mp0 -114.09 144.29 43.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.968 0.413 . . . . 0.0 111.317 178.617 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.799 ' CB ' HD11 ' A' ' 37' ' ' LEU . 13.4 tp -117.33 123.83 47.47 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.672 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.38 142.17 47.44 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.445 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.01 172.22 17.27 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.152 -178.591 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -116.06 133.58 55.87 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.751 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 32.1 m -130.73 134.52 46.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.131 0.491 . . . . 0.0 111.573 -179.104 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 4.0 ptpt -66.44 137.73 57.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.464 -179.473 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.9 p -85.06 -175.98 5.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.709 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.9 mmt85 -61.97 -30.46 70.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.809 0.337 . . . . 0.0 111.114 -179.811 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.84 9.04 10.73 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.839 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 66.77 38.46 3.82 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.292 0.568 . . . . 0.0 111.393 -178.739 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.463 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 13.9 mm100 -116.95 136.76 52.69 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 177.802 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -93.21 124.7 37.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.839 0.352 . . . . 0.0 111.549 -178.753 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.3 m -129.45 149.23 33.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.672 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.8 m -71.63 134.75 46.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.165 0.507 . . . . 0.0 111.523 -178.86 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.9 t -142.86 161.26 38.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.337 179.744 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -142.57 155.82 45.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.363 0.601 . . . . 0.0 111.848 -179.25 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.446 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.87 127.19 44.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.721 179.349 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -86.89 115.42 24.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.631 0.253 . . . . 0.0 110.946 -178.526 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.845 HD22 HD22 ' A' ' 69' ' ' LEU . 4.7 mp -85.87 -15.97 40.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.457 179.991 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.91 -47.28 74.58 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.366 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.405 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -92.05 -9.83 41.32 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 122.259 -0.275 . . . . 0.0 111.622 179.723 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.445 ' CE1' ' HB2' ' A' ' 100' ' ' TYR . 10.4 m80 -95.69 -67.02 0.87 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.535 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.503 HD13 ' CD1' ' A' ' 50' ' ' TRP . 12.9 mm -79.79 148.33 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.486 178.641 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.414 ' HB1' ' OG ' ' A' ' 53' ' ' SER . . . -141.03 171.75 13.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.511 -179.753 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.537 ' C ' HD12 ' A' ' 44' ' ' ILE . 21.0 t30 -113.16 112.8 24.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.144 -179.158 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.868 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.4 mp -113.25 88.96 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.952 0.406 . . . . 0.0 110.903 179.276 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 43.5 t0 70.89 38.16 1.2 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.075 179.924 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.72 0.36 89.19 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.161 179.464 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.4 m -110.57 135.71 50.8 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 117.107 0.454 . . . . 0.0 110.943 179.923 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.3 mt -77.61 118.45 20.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.635 0.731 . . . . 0.0 111.508 -178.114 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.868 ' HB2' HD13 ' A' ' 44' ' ' ILE . 28.4 mttt -137.41 162.75 32.8 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.102 -179.938 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.76 ' CE2' HG11 ' A' ' 90' ' ' VAL . 8.0 m-90 -85.95 119.39 26.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.921 0.391 . . . . 0.0 111.235 -179.648 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.428 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 14.6 tt0 -174.32 148.26 1.28 Allowed Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.344 -179.798 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 14.2 Cg_exo -66.43 70.28 0.45 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.374 2.049 . . . . 0.0 112.796 -179.061 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.414 ' OG ' ' HB1' ' A' ' 42' ' ' ALA . 3.0 p -162.73 133.67 4.87 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.006 179.026 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -81.19 107.19 13.78 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.991 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.461 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.6 p90 -47.62 -30.84 3.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.479 178.219 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.2 p -47.28 -17.87 0.09 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.874 -179.404 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.1 mm-40 -64.85 -30.75 71.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.648 0.261 . . . . 0.0 111.14 -179.339 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.501 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.7 p -125.86 4.54 7.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.428 179.716 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.5 m -116.84 148.18 41.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.286 0.565 . . . . 0.0 111.992 -178.898 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 43.0 p90 -142.82 157.88 44.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.796 -179.945 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.7 m-20 63.02 45.65 5.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.996 0.427 . . . . 0.0 110.421 -179.097 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.752 ' O ' HD22 ' A' ' 13' ' ' LEU . 62.9 m -69.96 136.31 50.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.371 179.803 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -140.77 151.23 44.27 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.719 -179.765 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.542 HG21 HD13 ' A' ' 19' ' ' LEU . 26.2 mt -130.32 139.7 50.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-O 121.287 0.565 . . . . 0.0 111.894 -179.901 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -139.36 111.01 7.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.051 178.901 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.15 -123.12 13.9 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.407 -0.901 . . . . 0.0 111.354 -178.644 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.423 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 22.9 p -102.3 -3.75 26.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.252 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.641 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.7 t -101.74 139.85 21.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.987 0.422 . . . . 0.0 111.627 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.845 HD22 HD22 ' A' ' 37' ' ' LEU . 6.4 tp -102.2 126.87 49.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.22 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.546 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.0 m -117.17 125.15 50.75 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.913 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.3 t -151.92 153.65 34.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.629 0.252 . . . . 0.0 111.422 -178.831 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 25.2 m -94.85 126.26 40.06 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.526 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 76.5 m -126.67 145.38 50.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.381 0.61 . . . . 0.0 112.577 -178.555 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -74.61 137.46 42.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.649 178.362 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -93.2 144.82 24.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.763 0.316 . . . . 0.0 110.553 179.63 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 m -52.21 -26.12 10.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.488 -179.44 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -82.89 0.24 45.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.387 179.9 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.06 136.78 7.45 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.833 179.779 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.33 -166.36 12.15 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 -178.68 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -132.3 142.82 49.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.198 0.499 . . . . 0.0 111.299 -179.453 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -153.97 128.8 9.45 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.104 -179.897 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -92.45 134.82 34.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.652 -179.255 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 60.2 p -122.03 157.99 30.14 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.357 179.755 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.5 m -122.44 145.86 47.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.754 0.312 . . . . 0.0 111.165 -179.804 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.693 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.7 tt -144.13 143.39 23.61 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.176 -179.526 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -96.41 113.35 24.92 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.7 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.564 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 12.9 mt -96.5 -5.47 39.36 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -178.878 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.796 ' OD1' HG22 ' A' ' 5' ' ' ILE . 53.0 t30 -44.71 -28.13 0.58 Allowed 'General case' 0 N--CA 1.467 0.417 0 O-C-N 122.111 -0.368 . . . . 0.0 111.936 -178.581 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 71.5 m -82.19 -39.37 23.25 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.896 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.76 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.4 m -72.89 -53.89 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -177.92 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.703 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.2 mp -82.57 147.73 5.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.935 0.397 . . . . 0.0 111.291 -179.066 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.428 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 6.7 tt0 -138.63 166.63 23.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.229 -178.839 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -107.08 99.77 9.3 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.13 0.49 . . . . 0.0 110.68 -179.769 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.445 HG21 ' CD ' ' A' ' 99' ' ' LYS . 39.2 t -98.33 96.83 5.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.035 179.421 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.8 t0 52.98 33.84 15.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.616 0.246 . . . . 0.0 111.535 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.2 28.6 12.91 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.414 179.397 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.6 t -141.24 135.28 30.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.822 0.344 . . . . 0.0 111.015 -179.961 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.428 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 67.9 mt -74.49 120.11 19.6 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.045 -179.787 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.476 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 10.7 mttm -122.47 139.13 54.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.932 -179.966 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.445 ' HB2' ' CE1' ' A' ' 40' ' ' HIS . 69.4 t80 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.579 -179.92 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.42 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 18.0 p90 . . . . . 0 N--CA 1.465 0.282 0 CA-C-O 120.603 0.239 . . . . 0.0 111.431 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.807 HG22 ' OD1' ' A' ' 88' ' ' ASN . 7.0 tp -63.41 -19.95 25.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.737 0.303 . . . . 0.0 111.159 -179.834 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -73.96 -24.01 59.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.676 179.25 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 p -118.58 13.96 13.49 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.445 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 62.1 m -130.76 154.72 47.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.992 0.425 . . . . 0.0 111.066 -179.595 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ARG . . . . . 0.406 ' NH2' ' CZ ' ' A' ' 30' ' ' PHE . 15.0 ptp180 -132.99 172.73 12.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.04 -179.812 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.427 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.4 p-10 48.51 57.22 6.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.164 179.688 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.659 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.9 p -79.24 133.48 36.67 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.255 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.802 ' O ' HD12 ' A' ' 19' ' ' LEU . 1.3 pp0? -157.9 163.77 37.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.417 -179.013 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.778 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.43 135.12 39.76 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.949 -179.873 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.1 144.98 46.31 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 178.796 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.96 -153.24 30.68 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 119.726 -1.226 . . . . 0.0 111.504 -178.955 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.4 -36.57 19.07 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.351 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.82 35.67 1.78 Allowed 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.804 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 10.7 mp0 -115.95 148.91 39.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.092 0.472 . . . . 0.0 111.985 178.892 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.805 ' CB ' HD11 ' A' ' 37' ' ' LEU . 15.4 tp -123.79 124.61 43.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.173 179.012 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.26 143.27 46.7 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.68 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.36 172.63 16.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.463 -178.438 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -113.53 133.51 55.21 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 177.532 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 63.3 m -131.03 134.76 46.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.117 0.484 . . . . 0.0 111.962 -179.082 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -67.27 136.49 55.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.526 -179.613 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.42 HG22 ' HA3' ' A' ' 96' ' ' GLY . 65.4 p -86.29 -178.9 6.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.521 179.814 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -60.29 -29.22 68.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.785 0.326 . . . . 0.0 110.957 -179.712 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.75 8.53 9.81 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.798 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 66.66 38.13 4.1 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.324 0.583 . . . . 0.0 111.086 -178.692 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.427 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 9.9 mt-30 -119.8 135.57 54.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.039 178.376 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.406 ' CZ ' ' NH2' ' A' ' 9' ' ' ARG . 50.3 m-85 -92.77 124.73 36.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.963 0.411 . . . . 0.0 111.35 -178.981 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.4 m -128.64 151.02 34.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.91 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.4 p -70.95 133.01 46.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.168 0.509 . . . . 0.0 111.835 -178.555 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.2 t -143.4 161.42 38.42 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.323 179.871 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -143.77 155.28 44.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.231 0.539 . . . . 0.0 111.904 -178.936 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.736 HD11 ' HD1' ' A' ' 100' ' ' TYR . 1.1 tp -135.44 126.36 44.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.274 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -87.2 117.23 25.81 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.709 0.29 . . . . 0.0 111.136 -178.337 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.909 HD22 HD22 ' A' ' 69' ' ' LEU . 3.9 mp -87.74 -15.59 36.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.986 -179.623 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -58.24 -43.5 87.85 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.39 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 4.0 m-20 -91.97 -10.08 40.65 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.024 -0.423 . . . . 0.0 111.195 179.084 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.565 ' CE1' ' CD1' ' A' ' 100' ' ' TYR . 9.1 m80 -96.74 -63.06 1.17 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.633 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.624 HD11 HD22 ' A' ' 87' ' ' LEU . 24.1 mm -80.59 149.87 4.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.547 178.443 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.527 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.0 172.05 13.32 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.398 -179.773 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.652 HD22 ' HA2' ' A' ' 46' ' ' GLY . 24.1 t-20 -112.7 107.8 16.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.017 -179.021 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 48.0 mm -109.81 91.07 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.182 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.7 t70 66.25 39.58 4.1 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.005 -179.822 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.652 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 81.39 1.18 89.97 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.729 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 m -108.56 137.74 46.01 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.912 0.387 . . . . 0.0 111.253 -179.883 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.465 HD12 ' O ' ' A' ' 83' ' ' SER . 20.4 mt -77.19 115.82 17.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.592 0.711 . . . . 0.0 111.341 -178.151 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -137.71 162.83 32.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.201 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.756 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 5.8 m-90 -86.67 122.38 30.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.892 0.377 . . . . 0.0 111.717 -179.35 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.527 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 1.8 mt-30 -172.14 149.52 2.21 Favored Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.133 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.416 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 53.7 Cg_endo -71.66 64.85 3.07 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 121.932 1.754 . . . . 0.0 112.353 -179.811 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.61 134.09 9.74 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.174 179.02 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.422 ' N ' ' OD1' ' A' ' 54' ' ' ASN . 0.2 OUTLIER -81.04 110.13 16.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.509 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.435 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 47.9 p90 -49.25 -30.31 7.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.88 178.529 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.4 p -49.33 -18.15 0.34 Allowed 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -179.025 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -62.21 -28.07 69.43 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.889 -0.324 . . . . 0.0 111.17 -179.104 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.0 p -128.73 -1.89 5.38 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 179.703 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 72' ' ' THR . 5.8 m -108.72 149.43 29.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.125 0.488 . . . . 0.0 112.083 -178.594 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.2 p90 -141.52 157.26 45.35 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.301 179.903 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 64.14 47.68 3.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.84 -179.197 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.778 ' O ' HD22 ' A' ' 13' ' ' LEU . 55.8 m -70.1 135.38 49.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.788 179.73 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.29 152.32 42.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.714 -179.921 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.597 HG21 HD13 ' A' ' 19' ' ' LEU . 45.7 mt -130.96 140.33 48.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.253 0.549 . . . . 0.0 111.974 -179.724 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -136.26 109.77 7.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.274 179.208 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.47 -119.82 13.6 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.303 -0.951 . . . . 0.0 110.939 -178.457 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.413 ' HB3' ' HB ' ' A' ' 5' ' ' ILE . 24.8 p -102.34 -3.29 27.36 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.464 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.5 t -101.9 136.97 31.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.022 0.439 . . . . 0.0 111.811 179.975 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.909 HD22 HD22 ' A' ' 37' ' ' LEU . 5.3 tp -101.8 125.48 48.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.301 179.813 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.546 ' N ' HD12 ' A' ' 69' ' ' LEU . 16.7 m -115.46 126.36 54.23 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.5 t -151.77 153.54 34.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.792 0.33 . . . . 0.0 111.649 -178.933 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.6 m -95.42 126.02 40.43 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.812 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.549 ' HB3' HD22 ' A' ' 43' ' ' ASN . 74.9 m -126.19 144.5 50.74 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.598 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -74.31 137.64 43.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.375 178.037 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.2 mtm-85 -91.94 142.37 27.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.668 0.27 . . . . 0.0 110.593 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.2 m -52.21 -27.0 13.03 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.612 -179.361 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -83.05 1.98 37.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.706 0.289 . . . . 0.0 111.393 179.924 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.49 134.07 6.53 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.497 -179.873 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.11 -171.07 13.58 Favored Glycine 0 C--N 1.318 -0.459 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.625 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -132.19 144.19 50.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 117.28 0.54 . . . . 0.0 111.337 -179.905 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -154.39 132.29 11.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.245 179.879 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -94.45 134.44 36.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.306 -179.642 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.465 ' O ' HD12 ' A' ' 48' ' ' LEU . 38.3 p -120.61 158.28 27.72 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.283 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.07 144.33 48.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.26 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.756 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.4 tt -144.51 143.83 22.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.693 179.913 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -98.0 118.31 34.32 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.942 179.524 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.636 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 4.8 mt -100.32 -6.05 26.45 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -179.06 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.807 ' OD1' HG22 ' A' ' 5' ' ' ILE . 52.3 t30 -44.63 -28.25 0.58 Allowed 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -178.349 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 13.2 m -82.2 -39.53 22.99 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.659 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -72.32 -52.62 23.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 N-CA-C 113.445 0.905 . . . . 0.0 113.445 -177.943 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.515 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -81.55 147.3 6.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.131 0.491 . . . . 0.0 111.238 -179.17 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.45 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 15.3 tt0 -137.62 165.63 25.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.061 -178.617 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -107.63 100.16 9.58 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.235 0.54 . . . . 0.0 110.728 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.2 t -98.34 98.44 7.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.78 179.039 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.8 t0 54.17 32.55 16.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.672 0.272 . . . . 0.0 111.41 -179.801 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.42 ' HA3' HG22 ' A' ' 25' ' ' THR . . . 93.49 28.46 11.41 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.316 179.297 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.1 m -140.38 137.35 33.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.918 0.39 . . . . 0.0 111.571 -179.846 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.45 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 57.0 mt -74.38 119.04 18.04 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.686 179.873 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.434 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.5 mttm -126.57 145.35 50.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.671 -179.112 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.736 ' HD1' HD11 ' A' ' 35' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.023 179.406 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.417 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 13.2 p90 . . . . . 0 N--CA 1.467 0.42 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.778 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.5 tp -62.64 -19.14 22.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.601 0.239 . . . . 0.0 111.544 -179.467 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -74.38 -25.64 59.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.615 0.245 . . . . 0.0 111.037 179.293 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.1 p -118.91 -0.94 11.09 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.641 179.287 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 80.6 m -109.84 151.42 27.03 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.898 0.38 . . . . 0.0 111.279 -179.706 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.1 172.24 12.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.015 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 48.88 58.76 4.98 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -179.871 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.749 HG21 ' CD1' ' A' ' 5' ' ' ILE . 12.6 p -79.25 134.07 36.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.84 178.622 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.69 ' O ' HD12 ' A' ' 19' ' ' LEU . 2.5 pt20 -157.26 163.65 38.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.507 -179.183 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.774 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.66 135.42 39.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.097 -179.869 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -118.61 144.17 46.31 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 178.657 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.81 -152.11 32.3 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 119.753 -1.213 . . . . 0.0 111.566 -179.01 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.99 -36.64 18.14 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.413 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.73 34.87 1.79 Allowed 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -178.588 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.8 OUTLIER -115.36 148.54 39.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.106 0.479 . . . . 0.0 112.06 178.788 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.817 ' CB ' HD11 ' A' ' 37' ' ' LEU . 12.6 tp -122.31 123.76 42.17 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.46 179.504 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.07 143.97 47.84 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.901 0.381 . . . . 0.0 110.031 179.405 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.6 172.56 16.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.876 -178.539 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -112.56 133.57 54.55 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 176.893 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 58.4 m -130.59 133.57 46.29 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.51 -0.476 . . . . 0.0 112.026 -178.924 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 3.7 ptpt -66.03 136.95 56.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.664 -179.78 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.496 HG22 ' O ' ' A' ' 95' ' ' ASP . 63.7 p -85.98 -176.92 6.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.566 179.872 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -61.52 -29.72 70.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.674 0.273 . . . . 0.0 111.183 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.0 8.39 10.71 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.622 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 66.26 38.08 4.69 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.216 0.531 . . . . 0.0 111.196 -178.725 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.412 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 32.9 mt-30 -118.58 135.83 54.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.664 178.307 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -92.88 124.53 36.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.061 0.458 . . . . 0.0 111.786 -178.518 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.7 m -130.3 151.29 35.65 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.723 -179.983 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.4 t -72.44 136.46 46.01 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.166 0.508 . . . . 0.0 112.079 -178.723 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 t -145.13 161.72 38.8 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.265 179.884 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt -143.1 157.19 44.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.48 0.657 . . . . 0.0 112.177 -179.215 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.467 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.7 OUTLIER -136.74 125.6 36.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.922 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -88.32 119.56 28.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.621 0.248 . . . . 0.0 110.977 -177.93 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 69' ' ' LEU . 3.9 mp -88.94 -14.88 35.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.488 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.2 p-10 -57.4 -45.61 84.35 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.222 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.436 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 3.8 p30 -92.83 -10.48 36.64 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.906 -0.496 . . . . 0.0 111.377 178.567 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.47 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 9.5 m-70 -94.29 -66.07 0.94 Allowed 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.959 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.622 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.6 mp -81.24 150.64 4.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.938 178.809 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.542 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.98 171.68 13.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.808 -179.032 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.541 ' C ' HD12 ' A' ' 44' ' ' ILE . 27.3 t-20 -113.25 111.52 22.18 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.367 -179.202 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.79 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.4 mp -112.45 89.32 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-O 120.918 0.389 . . . . 0.0 111.161 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t0 67.32 38.13 3.37 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.937 179.369 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.467 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 85.54 0.85 87.98 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.473 -0.87 . . . . 0.0 113.158 179.307 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.1 m -112.94 136.48 52.56 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.193 0.496 . . . . 0.0 110.842 179.776 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.9 mt -77.38 117.97 19.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.649 0.738 . . . . 0.0 112.541 -177.521 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.79 ' HB2' HD13 ' A' ' 44' ' ' ILE . 40.6 mttt -139.61 163.01 33.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.545 179.475 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.766 ' CH2' HD11 ' A' ' 85' ' ' ILE . 9.5 m-90 -87.7 127.08 35.3 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.892 0.331 . . . . 0.0 111.892 -179.4 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.542 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.1 OUTLIER -172.92 159.14 3.57 Favored Pre-proline 0 N--CA 1.468 0.432 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.686 -179.785 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -77.02 61.55 7.21 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 122.118 1.879 . . . . 0.0 112.142 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.1 p -156.47 135.34 11.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.85 -1.068 . . . . 0.0 108.599 179.193 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.29 109.87 16.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.227 0.536 . . . . 0.0 112.139 -178.182 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -46.41 -30.02 1.96 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.087 178.764 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.6 p -50.65 -17.11 0.47 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -179.049 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -61.2 -29.37 69.77 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.838 -179.308 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.3 p -129.68 0.63 4.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.531 179.249 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.9 m -110.86 148.3 32.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.3 0.572 . . . . 0.0 112.06 -178.581 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -141.72 157.53 44.94 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.021 -179.682 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.8 m120 63.71 45.62 4.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.912 0.387 . . . . 0.0 110.879 -179.356 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.774 ' O ' HD22 ' A' ' 13' ' ' LEU . 58.1 m -69.01 137.2 53.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.513 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.408 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -143.58 152.13 41.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.071 -179.433 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.507 HG21 HD13 ' A' ' 19' ' ' LEU . 39.9 mt -131.01 140.27 49.05 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 121.302 0.573 . . . . 0.0 112.239 -179.898 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -137.88 110.68 7.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.273 179.271 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.66 -121.71 17.95 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.368 -0.92 . . . . 0.0 111.171 -178.602 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.414 ' HB3' HG21 ' A' ' 5' ' ' ILE . 21.1 p -100.49 -2.92 31.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.984 0.392 . . . . 0.0 112.002 -179.408 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.579 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.4 t -103.57 138.41 28.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -179.633 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 37' ' ' LEU . 6.7 tp -102.85 124.64 48.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.615 179.606 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.466 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.7 m -115.52 126.65 54.54 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -179.948 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.2 t -151.89 153.8 34.87 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.128 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 8.3 m -95.06 126.42 40.39 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 178.814 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.532 ' HB3' HD22 ' A' ' 43' ' ' ASN . 73.4 m -127.32 146.3 50.49 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -178.266 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -75.82 137.29 40.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.631 178.042 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 47.8 mtm-85 -92.06 146.04 24.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.743 0.306 . . . . 0.0 110.601 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.1 m -51.92 -31.41 28.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.851 -179.169 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -81.74 2.82 28.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.619 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.19 136.27 6.83 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.34 -179.82 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.0 -173.46 14.71 Favored Glycine 0 C--N 1.317 -0.498 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 -178.41 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -131.65 143.24 50.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.398 0.599 . . . . 0.0 111.484 -179.798 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -154.44 130.81 10.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.38 179.563 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 0.9 OUTLIER -92.46 134.28 35.1 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.157 -179.763 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.6 p -119.72 158.65 26.06 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.383 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.47 144.66 48.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.338 -179.52 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.766 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.8 tt -146.97 145.01 19.71 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.577 179.728 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -98.25 118.7 35.47 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.648 179.502 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.533 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 7.0 mt -99.72 -6.46 27.07 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -178.738 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.778 ' OD1' HG22 ' A' ' 5' ' ' ILE . 39.0 t30 -45.06 -28.61 0.73 Allowed 'General case' 0 N--CA 1.468 0.442 0 O-C-N 122.17 -0.331 . . . . 0.0 111.825 -178.532 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 7.5 m -80.35 -39.61 28.22 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.705 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.0 m -73.5 -52.58 20.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -178.367 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.614 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.1 mp -81.75 147.32 6.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.927 0.394 . . . . 0.0 111.235 -179.174 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -137.16 165.42 26.14 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.179 -178.709 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -106.4 99.83 9.39 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.133 0.492 . . . . 0.0 110.708 -179.651 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.7 t -99.26 96.75 5.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.171 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.496 ' O ' HG22 ' A' ' 25' ' ' THR . 15.8 t0 52.7 33.37 13.74 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 179.742 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.23 28.43 11.72 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.748 -0.739 . . . . 0.0 113.206 179.235 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.0 t -141.63 134.31 28.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.779 0.323 . . . . 0.0 111.174 -179.831 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.409 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 73.8 mt -74.75 120.34 20.16 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.054 0.454 . . . . 0.0 110.88 179.923 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -123.3 138.97 54.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.281 -179.71 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.47 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 36.2 t80 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.476 179.518 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.464 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 22.7 p90 . . . . . 0 N--CA 1.464 0.235 0 CA-C-O 120.585 0.231 . . . . 0.0 111.289 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.805 HG22 ' OD1' ' A' ' 88' ' ' ASN . 6.4 tp -64.46 -16.32 19.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.714 0.292 . . . . 0.0 111.397 -179.871 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -76.04 -24.95 55.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.817 0.342 . . . . 0.0 110.802 179.36 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.4 p -118.29 -4.04 10.96 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.656 179.775 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 60.4 m -109.69 153.64 23.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.161 0.505 . . . . 0.0 111.067 -179.557 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 22.2 ptt180 -132.27 173.03 11.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.615 -179.948 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.402 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.9 p-10 49.12 58.01 5.85 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.011 0.434 . . . . 0.0 112.027 179.867 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.616 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.1 p -79.31 130.02 35.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.952 178.801 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.708 ' O ' HD12 ' A' ' 19' ' ' LEU . 1.8 pt20 -156.15 163.15 39.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.38 -179.403 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.72 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.64 136.57 37.82 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.467 179.901 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -121.03 144.6 48.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.071 179.273 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.21 -152.09 29.86 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 119.85 -1.167 . . . . 0.0 111.36 -178.759 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.16 -37.07 19.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.098 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.34 36.59 1.69 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.92 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 3.2 mp0 -115.71 145.74 42.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.15 0.5 . . . . 0.0 111.512 178.922 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.806 ' CB ' HD11 ' A' ' 37' ' ' LEU . 13.3 tp -119.92 123.79 44.42 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 178.913 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.29 142.89 46.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.876 0.369 . . . . 0.0 110.041 179.595 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.22 172.28 16.96 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.001 -178.795 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -114.39 133.55 55.63 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.69 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.407 ' SG ' HD21 ' A' ' 98' ' ' LEU . 39.4 m -130.61 133.38 46.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.134 0.492 . . . . 0.0 111.709 -179.12 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 3.1 ptpt -66.59 137.99 57.15 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.451 -179.624 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 21.1 p -85.48 -177.13 6.36 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.637 179.862 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.4 mtt-85 -61.33 -30.35 70.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.298 -179.673 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.77 9.46 9.7 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -179.099 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 66.84 38.34 3.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.223 0.535 . . . . 0.0 111.609 -178.838 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.503 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 16.0 mm100 -116.8 137.68 52.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.811 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -94.65 124.77 38.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.896 0.379 . . . . 0.0 111.883 -178.778 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 23.5 m -130.47 151.47 35.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.914 179.543 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.3 m -72.45 134.87 45.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.223 0.535 . . . . 0.0 111.617 -178.842 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.2 t -141.75 161.51 37.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.002 179.713 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -140.74 154.14 46.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.462 0.649 . . . . 0.0 112.007 -178.895 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.477 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -138.36 122.58 21.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.0 -1.0 . . . . 0.0 108.61 179.214 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -86.57 119.14 26.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.824 0.345 . . . . 0.0 110.863 -178.646 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.848 HD22 HD22 ' A' ' 69' ' ' LEU . 4.4 mp -87.0 -15.56 38.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.757 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.447 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -57.49 -45.92 84.31 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.024 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.447 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.3 m-20 -92.13 -10.04 40.33 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 122.101 -0.375 . . . . 0.0 111.53 179.599 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 16.1 m80 -98.63 -67.45 0.85 Allowed 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.799 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.561 HD12 ' N ' ' A' ' 41' ' ' ILE . 3.3 mp -81.13 149.71 4.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.407 178.783 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.474 ' HB3' ' CG ' ' A' ' 51' ' ' GLN . . . -141.4 172.57 12.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.148 -179.37 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.482 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 12.9 t30 -112.45 114.68 27.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.98 179.682 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.703 HD11 ' OE1' ' A' ' 51' ' ' GLN . 49.7 mm -113.41 89.35 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.384 -179.641 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 56.8 t0 71.12 38.53 1.08 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.95 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.41 0.68 88.25 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.889 179.779 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.9 m -115.2 136.29 53.26 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.917 0.389 . . . . 0.0 110.814 179.793 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.6 mt -77.5 120.26 22.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.516 0.674 . . . . 0.0 111.545 -178.16 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -135.37 162.06 33.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.873 179.877 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.769 ' CE2' HG11 ' A' ' 90' ' ' VAL . 8.0 m-90 -89.2 117.61 28.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.061 0.458 . . . . 0.0 112.193 -179.065 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.703 ' OE1' HD11 ' A' ' 44' ' ' ILE . 3.0 pt20 -178.55 151.12 0.72 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.974 178.656 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.415 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 28.4 Cg_endo -63.21 81.98 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.263 1.975 . . . . 0.0 113.118 -178.697 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.414 ' OG ' ' CB ' ' A' ' 42' ' ' ALA . 3.0 p -172.38 131.92 0.61 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.018 178.938 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.81 108.87 15.69 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -177.921 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 25.1 p90 -47.91 -29.77 3.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.469 178.544 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.7 p -48.8 -15.92 0.11 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.217 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -64.63 -30.79 71.82 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.599 -178.79 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.482 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -129.75 2.81 4.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.504 0.192 . . . . 0.0 111.301 179.763 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.6 m -112.2 148.03 34.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.207 0.527 . . . . 0.0 111.827 -179.013 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -142.48 157.37 44.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.017 -179.724 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 63.33 47.61 3.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.961 0.41 . . . . 0.0 110.693 -179.187 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.72 ' O ' HD22 ' A' ' 13' ' ' LEU . 21.1 m -70.11 136.36 50.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.598 179.865 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.513 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.04 152.09 43.04 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.494 179.791 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.499 HG21 HD13 ' A' ' 19' ' ' LEU . 34.6 mt -130.28 140.6 48.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.219 0.533 . . . . 0.0 111.649 -179.933 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -137.44 110.6 7.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.236 -0.893 . . . . 0.0 108.99 179.059 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.68 -122.33 16.9 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.24 -0.981 . . . . 0.0 111.179 -178.651 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.427 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 20.8 p -101.18 -4.33 27.43 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -179.521 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.509 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.5 t -101.74 139.56 22.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.969 0.414 . . . . 0.0 111.691 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.848 HD22 HD22 ' A' ' 37' ' ' LEU . 8.0 tp -102.22 127.82 49.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.356 179.834 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.524 ' N ' HD12 ' A' ' 69' ' ' LEU . 6.8 m -117.24 124.34 48.82 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.6 t -151.26 153.32 34.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.686 -0.233 . . . . 0.0 111.159 -178.881 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.9 m -93.14 125.96 38.0 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.015 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.3 m -127.14 144.34 51.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.316 0.579 . . . . 0.0 112.52 -178.774 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -74.84 138.1 42.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.857 178.454 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 59.5 mtp180 -92.65 143.55 26.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.66 0.267 . . . . 0.0 110.53 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.2 m -51.83 -25.63 8.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.565 -0.288 . . . . 0.0 111.448 -179.429 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -82.79 0.84 41.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.762 0.315 . . . . 0.0 111.442 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.36 135.86 6.73 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.437 -179.935 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.55 -168.49 12.76 Favored Glycine 0 C--N 1.319 -0.386 0 N-CA-C 111.298 -0.721 . . . . 0.0 111.298 -178.742 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -131.19 141.63 50.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 117.145 0.473 . . . . 0.0 111.246 -179.626 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -154.28 130.71 10.54 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.26 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -93.35 134.37 35.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.303 -179.478 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 p -120.9 158.47 27.59 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.902 0.382 . . . . 0.0 110.542 179.911 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 60.5 p -120.6 143.74 48.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.751 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 14.4 tt -144.51 142.07 23.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.382 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -96.31 116.6 29.28 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.213 179.876 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.662 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 10.0 mt -96.64 -6.64 36.18 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -179.025 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.805 ' OD1' HG22 ' A' ' 5' ' ' ILE . 55.8 t30 -44.99 -29.48 0.84 Allowed 'General case' 0 N--CA 1.466 0.355 0 O-C-N 122.186 -0.322 . . . . 0.0 111.705 -178.652 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.75 -41.0 24.24 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.947 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.769 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -71.01 -53.19 22.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 113.358 0.874 . . . . 0.0 113.358 -177.91 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.57 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.81 147.79 5.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.992 0.425 . . . . 0.0 111.568 -178.836 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.412 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 13.4 tt0 -137.02 165.66 25.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.866 -179.074 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -107.57 99.71 9.19 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.112 0.482 . . . . 0.0 110.25 179.837 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 94' ' ' VAL . . . . . 0.401 HG23 ' HB2' ' A' ' 99' ' ' LYS . 38.9 t -98.81 96.69 5.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.136 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.8 t0 52.75 33.99 15.23 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.716 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.5 28.07 12.05 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.845 -0.693 . . . . 0.0 113.389 179.155 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.1 t -141.89 135.46 29.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.789 0.328 . . . . 0.0 111.401 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.412 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 64.3 mt -73.59 119.26 17.57 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.425 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.405 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.0 mttm -125.29 148.63 48.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.647 -178.995 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.9 t80 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.902 -179.841 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.407 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 15.8 p90 . . . . . 0 N--CA 1.464 0.262 0 CA-C-O 120.597 0.237 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.801 ' CD1' HG21 ' A' ' 11' ' ' THR . 3.9 tp -66.06 -13.64 16.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.727 0.299 . . . . 0.0 111.101 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -77.34 -27.36 52.74 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.016 0.436 . . . . 0.0 109.874 178.932 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 42.6 p -118.74 11.22 12.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.138 178.755 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.7 m -124.94 149.88 47.18 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.153 0.501 . . . . 0.0 111.616 -179.043 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -133.64 173.0 11.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.797 179.764 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 p30 49.99 56.91 7.16 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.792 0.437 . . . . 0.0 112.07 -179.743 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.801 HG21 ' CD1' ' A' ' 5' ' ' ILE . 25.0 p -79.27 133.8 36.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.898 178.588 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.688 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.9 pt20 -157.09 163.68 38.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.571 -179.166 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.761 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.7 136.08 38.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.905 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.92 144.31 48.51 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.1 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.67 -152.92 34.07 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 119.866 -1.159 . . . . 0.0 111.281 -178.859 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.57 -37.05 20.02 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.43 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -142.09 35.61 1.54 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -179.085 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 2.1 mp0 -113.28 147.27 37.91 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.959 0.409 . . . . 0.0 111.511 178.604 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.807 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.9 tp -119.65 124.79 47.14 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.983 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.01 143.32 49.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.531 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.65 172.64 15.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.187 -178.795 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -111.2 133.85 53.23 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.044 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.3 m -130.82 133.98 46.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.124 0.488 . . . . 0.0 111.881 -179.089 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 8.3 ptpt -66.03 136.79 56.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.382 -179.606 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.8 p -85.45 -176.29 6.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.52 179.85 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 39.4 mtm180 -61.54 -30.68 70.8 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.642 0.258 . . . . 0.0 111.316 -179.615 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.86 9.89 10.97 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.097 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 66.57 39.45 3.75 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.263 0.554 . . . . 0.0 111.614 -178.795 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.434 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 50.0 mt-30 -117.12 136.44 53.0 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.565 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -92.56 124.33 36.51 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.614 -178.688 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.6 m -128.89 149.08 33.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.354 179.448 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.7 m -72.36 136.7 46.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.269 0.557 . . . . 0.0 111.616 -178.847 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -142.17 161.21 38.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.148 179.668 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.9 154.22 47.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.394 0.616 . . . . 0.0 112.012 -179.379 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.512 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -136.89 126.43 37.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.096 -0.957 . . . . 0.0 108.858 179.656 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -87.94 115.52 25.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.609 0.243 . . . . 0.0 111.622 -178.032 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.912 HD22 HD22 ' A' ' 69' ' ' LEU . 3.8 mp -87.03 -16.33 35.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.22 179.359 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.66 -45.13 81.86 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.691 0.281 . . . . 0.0 111.399 -178.863 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.409 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -92.05 -10.49 38.95 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 122.241 -0.287 . . . . 0.0 111.617 179.633 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 40' ' ' HIS . . . . . 0.487 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 17.7 m-70 -97.43 -64.47 1.04 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.503 HD11 HD22 ' A' ' 87' ' ' LEU . 29.8 mm -79.77 148.05 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.645 179.026 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -140.01 172.04 13.33 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.603 -179.775 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.54 ' C ' HD12 ' A' ' 44' ' ' ILE . 32.9 t30 -113.02 111.23 21.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.378 -178.939 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.763 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.2 mp -111.21 89.49 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.915 179.289 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.1 t70 67.95 38.14 2.87 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.105 -179.958 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.71 2.39 88.71 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.627 -0.797 . . . . 0.0 113.231 179.448 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.2 m -111.5 136.32 50.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.201 0.501 . . . . 0.0 111.162 -179.946 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.1 mt -77.5 117.47 18.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.616 0.722 . . . . 0.0 111.384 -178.199 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.763 ' HB2' HD13 ' A' ' 44' ' ' ILE . 8.9 mttm -138.45 163.01 33.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.128 -179.841 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 50' ' ' TRP . . . . . 0.726 ' CE2' HG11 ' A' ' 90' ' ' VAL . 7.3 m-90 -85.91 119.82 26.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.991 0.424 . . . . 0.0 111.493 -179.464 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.454 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 40.5 tt0 -174.99 143.52 0.77 Allowed Pre-proline 0 N--CA 1.463 0.221 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.359 -179.983 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.454 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 29.6 Cg_endo -64.68 72.09 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 122.289 1.993 . . . . 0.0 112.868 -179.171 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.9 p -163.44 133.8 4.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.4 178.932 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.47 ' N ' ' OD1' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.41 109.88 15.33 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.682 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 12.7 p90 -50.09 -30.47 11.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.721 178.522 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.421 ' N ' ' CD1' ' A' ' 55' ' ' PHE . 77.3 p -48.4 -19.63 0.33 Allowed 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -179.196 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -60.49 -26.29 66.71 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.944 -0.302 . . . . 0.0 111.073 -179.096 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.449 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -132.08 0.29 3.8 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.501 179.204 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 59' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.3 m -110.95 148.35 32.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.159 0.504 . . . . 0.0 111.912 -178.75 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -143.47 157.79 44.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.081 -179.739 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 64.6 45.46 3.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.922 0.391 . . . . 0.0 110.884 -179.41 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.761 ' O ' HD22 ' A' ' 13' ' ' LEU . 68.1 m -69.54 136.29 51.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.777 179.893 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.24 150.51 42.73 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.318 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.476 ' CG1' HD13 ' A' ' 69' ' ' LEU . 35.2 mt -129.13 138.98 53.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.301 0.572 . . . . 0.0 111.631 179.93 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -136.27 110.22 8.22 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.374 179.265 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.85 -121.09 13.58 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.403 -0.903 . . . . 0.0 110.982 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.408 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 26.9 p -101.85 -5.7 24.47 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -179.259 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.556 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.5 t -101.03 141.28 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.075 0.465 . . . . 0.0 111.773 179.693 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.912 HD22 HD22 ' A' ' 37' ' ' LEU . 5.4 tp -103.96 126.63 51.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.565 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.586 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.5 m -116.05 125.88 53.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.325 -179.956 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.3 t -151.7 153.83 35.14 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.625 0.25 . . . . 0.0 111.336 -179.294 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.2 m -94.08 125.95 39.02 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.651 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 93.0 m -124.53 142.89 51.0 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -178.41 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -73.14 137.06 44.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.657 178.42 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -92.29 142.42 27.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.632 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 m -52.05 -29.23 20.37 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.476 -179.499 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -82.45 1.27 38.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.45 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.35 135.81 7.61 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.99 179.646 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.07 -169.89 13.14 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -131.27 142.66 50.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.32 0.56 . . . . 0.0 111.142 -179.899 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -153.84 128.18 9.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.029 -179.697 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 5.2 t -92.64 134.96 34.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.685 -179.028 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 64.1 p -121.33 158.38 28.35 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.375 179.954 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.0 m -122.83 144.81 48.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.976 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.686 HD11 ' CH2' ' A' ' 50' ' ' TRP . 12.0 tt -144.91 142.83 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.815 -179.818 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -95.3 115.46 27.46 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.93 179.597 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.579 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 14.9 mt -97.01 -5.29 38.06 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -179.343 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.8 ' OD1' HG22 ' A' ' 5' ' ' ILE . 53.7 t30 -44.42 -28.95 0.62 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.447 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 64.5 m -82.23 -38.07 25.05 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.749 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 90' ' ' VAL . . . . . 0.726 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -74.09 -52.96 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -177.996 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.589 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.59 146.41 7.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.032 0.444 . . . . 0.0 111.292 -179.161 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 92' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 22.1 tt0 -137.38 167.07 22.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.077 -178.851 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -107.18 99.43 8.97 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.131 0.491 . . . . 0.0 110.501 -179.745 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.5 t -97.77 95.88 4.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.826 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.9 t0 54.16 33.8 18.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.659 0.266 . . . . 0.0 111.549 179.939 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.37 28.55 12.76 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.97 179.631 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.5 t -139.82 134.25 31.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.85 0.357 . . . . 0.0 111.187 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.414 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 71.8 mt -73.51 120.09 18.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.57 179.951 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 99' ' ' LYS . . . . . 0.409 ' O ' ' N ' ' A' ' 92' ' ' GLU . 18.8 mttt -124.93 130.95 53.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.565 -178.927 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 100' ' ' TYR . . . . . 0.487 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 26.3 t80 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.365 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.226 0 N-CA-C 112.573 -0.211 . . . . 3.9300000000000002 112.573 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.407 ' O ' ' O ' ' A' ' 89' ' ' SER . 2.8 tp -144.73 30.52 1.2 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.847 0.356 . . . . 2.5699999999999998 110.956 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 143.84 -98.54 0.21 Allowed Glycine 0 C--N 1.329 0.175 0 N-CA-C 111.434 -0.666 . . . . 1.6299999999999999 111.434 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 71.6 mttt 65.95 80.57 0.22 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.034 0.445 . . . . 1.8200000000000001 111.68 179.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -92.25 -36.58 13.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.66 -0.7 . . . . 0.26000000000000001 110.661 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.835 HG22 ' OD1' ' A' ' 88' ' ' ASN . 2.2 tp -63.03 -19.42 23.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 0.20999999999999999 111.569 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -75.65 -27.25 58.3 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.904 -0.318 . . . . 2.0099999999999998 111.151 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 50.6 p -118.78 14.11 13.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.519 -0.31 . . . . 0.33000000000000002 111.501 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.2 m -129.67 151.32 50.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.067 0.461 . . . . 0.17000000000000001 111.353 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.62 172.83 12.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.715 -0.675 . . . . 2.5600000000000001 110.723 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.44 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 4.9 p-10 49.16 56.05 8.38 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.211 -0.45 . . . . 1.24 111.875 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.1 p -79.19 134.1 36.69 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.733 -0.469 . . . . 0.34000000000000002 109.733 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.757 ' O ' HD12 ' A' ' 19' ' ' LEU . 15.3 pt20 -157.26 163.41 38.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.125 -0.489 . . . . 1.3500000000000001 111.511 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.68 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.35 136.56 37.65 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.713 -0.676 . . . . 0.089999999999999997 110.958 -179.664 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.58 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.1 146.29 46.08 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.319 -0.855 . . . . 0.10000000000000001 109.324 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.21 -152.64 24.5 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.002 -1.094 . . . . 0.11 111.438 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.52 -36.41 18.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.014 0.407 . . . . 0.13 111.352 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.538 ' OG ' ' HB3' ' A' ' 38' ' ' ASP . 8.0 p -144.71 72.17 1.33 Allowed 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.509 -0.923 . . . . 0.16 108.509 179.357 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.58 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 4.5 mp0 -146.13 141.19 27.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.538 -0.756 . . . . 1.1299999999999999 111.508 176.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.757 HD12 ' O ' ' A' ' 12' ' ' GLN . 21.2 tp -121.45 120.98 36.52 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.102 -0.703 . . . . 0.12 109.102 177.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.42 144.33 45.1 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.712 -0.477 . . . . 0.089999999999999997 109.712 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.56 172.51 16.24 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.061 -0.518 . . . . 0.10000000000000001 110.729 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -112.83 133.25 54.91 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.163 -1.051 . . . . 1.5800000000000001 108.163 176.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 59.0 m -131.0 136.39 48.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.228 0.537 . . . . 0.14000000000000001 112.025 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 5.4 ptpt -68.03 135.22 51.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.465 -0.789 . . . . 0.79000000000000004 111.632 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.7 p -87.03 -175.43 5.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.246 -0.888 . . . . 0.17000000000000001 110.617 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -59.16 -33.73 71.26 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.604 0.594 . . . . 2.98 112.604 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.45 11.67 8.2 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.554 0.576 . . . . 0.17000000000000001 112.554 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 67.09 41.86 2.51 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.589 0.709 . . . . 1.8300000000000001 110.497 -178.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.479 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 11.5 mt-30 -116.68 132.63 56.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.692 -1.14 . . . . 1.9199999999999999 108.513 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.408 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 77.4 m-85 -90.66 124.21 34.89 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.495 -0.482 . . . . 0.96999999999999997 110.727 -179.416 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.7 m -122.29 160.89 23.89 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-O 120.974 0.416 . . . . 0.16 111.584 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.46 126.5 31.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.844 -0.616 . . . . 1.28 111.151 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.5 t -140.42 157.46 45.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.327 -0.397 . . . . 0.13 110.779 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -145.9 142.35 28.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.236 0.541 . . . . 1.6000000000000001 112.106 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.445 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.9 tp -118.57 126.62 75.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.367 -0.833 . . . . 0.11 108.77 178.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -87.3 118.64 26.87 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 122.271 -0.268 . . . . 0.94999999999999996 110.672 -178.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.723 HD22 HD22 ' A' ' 69' ' ' LEU . 4.7 mp -87.56 -16.05 35.71 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.353 0.501 . . . . 0.11 112.353 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.538 ' HB3' ' OG ' ' A' ' 17' ' ' SER . 23.3 p30 -56.07 -45.38 79.33 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.582 0.586 . . . . 1.8899999999999999 112.582 -177.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.533 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 2.5 p30 -91.37 -10.25 41.87 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 122.261 -0.274 . . . . 1.6599999999999999 111.699 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 17.3 m80 -97.32 -64.21 1.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.747 -0.464 . . . . 0.23999999999999999 109.747 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.487 HG13 HD23 ' A' ' 37' ' ' LEU . 25.6 mm -81.01 151.27 4.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.85 -0.614 . . . . 1.0 111.358 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.507 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.15 172.18 13.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.495 -0.775 . . . . 0.14999999999999999 111.327 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.611 ' CG ' ' HG1' ' A' ' 58' ' ' THR . 23.4 t-20 -111.34 110.91 21.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.943 -0.571 . . . . 0.14999999999999999 110.614 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.6 mm -110.39 92.34 2.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.947 -0.569 . . . . 1.0 112.004 -179.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 20.4 t0 62.65 37.18 13.06 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.777 0.323 . . . . 1.1299999999999999 111.252 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.491 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 85.26 0.79 88.5 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.612 -0.804 . . . . 0.14000000000000001 112.942 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.5 m -113.18 135.5 53.75 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.982 0.391 . . . . 0.20000000000000001 110.649 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.401 HD12 ' OG ' ' A' ' 83' ' ' SER . 21.2 mt -77.04 118.72 19.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.604 0.716 . . . . 0.20000000000000001 110.95 -178.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -137.15 162.51 33.23 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 114.654 -1.157 . . . . 1.3300000000000001 110.042 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.798 ' CH2' HD11 ' A' ' 85' ' ' ILE . 9.7 m-90 -85.54 119.15 25.57 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.999 0.428 . . . . 0.26000000000000001 111.466 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.507 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 13.1 tt0 -174.9 141.22 0.69 Allowed Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.829 -0.623 . . . . 1.79 110.131 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -66.07 70.18 0.4 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.195 1.93 . . . . 0.40000000000000002 112.979 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.46 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.0 p -155.08 137.32 14.83 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.831 -1.077 . . . . 0.26000000000000001 108.154 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.406 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.5 OUTLIER -80.95 104.2 11.3 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.097 0.777 . . . . 0.81000000000000005 113.097 -176.806 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.528 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 44.2 p90 -51.9 -36.59 49.35 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.195 -0.911 . . . . 0.52000000000000002 110.108 177.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 77.5 p -45.82 -25.1 0.46 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 114.938 -1.028 . . . . 0.27000000000000002 112.939 -178.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -66.27 -20.24 66.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.676 0.275 . . . . 1.73 111.352 -179.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.611 ' HG1' ' CG ' ' A' ' 43' ' ' ASN . 30.1 p -128.69 6.71 5.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.485 -0.325 . . . . 0.17000000000000001 111.007 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.2 m -126.45 149.67 49.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.209 0.528 . . . . 0.10000000000000001 111.703 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.3 p90 -142.42 157.86 44.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.319 -0.855 . . . . 0.95999999999999996 109.817 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 54.1 m-20 63.38 46.65 4.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.096 0.474 . . . . 0.94999999999999996 110.639 -179.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.68 ' O ' HD22 ' A' ' 13' ' ' LEU . 46.1 m -69.37 135.11 49.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.847 -0.615 . . . . 0.14999999999999999 110.178 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.431 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -141.96 150.04 40.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.493 . . . . 0.11 111.703 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.542 HG13 ' HB2' ' A' ' 13' ' ' LEU . 38.6 mt -130.45 142.44 43.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.222 0.534 . . . . 0.11 111.86 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -139.64 111.93 7.64 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.253 -0.885 . . . . 1.7 108.847 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.571 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 66.75 -122.97 21.32 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.242 -0.98 . . . . 0.12 111.58 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.602 ' N ' HD13 ' A' ' 5' ' ' ILE . 82.5 p -100.36 -5.64 26.99 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.492 0.553 . . . . 0.14999999999999999 112.492 -178.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.479 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.6 t -102.8 139.87 22.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 121.052 0.453 . . . . 0.14000000000000001 111.692 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.723 HD22 HD22 ' A' ' 37' ' ' LEU . 7.1 tp -102.25 126.95 49.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.824 -0.625 . . . . 0.12 110.89 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.51 ' N ' HD12 ' A' ' 69' ' ' LEU . 4.5 m -116.04 123.99 49.32 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.962 -0.385 . . . . 0.14000000000000001 109.962 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.425 ' O ' ' HA ' ' A' ' 82' ' ' THR . 11.2 t -151.54 153.38 34.43 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.253 -0.179 . . . . 0.12 111.245 -178.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.57 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 15.6 m -95.72 126.47 41.01 Favored 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 109.832 -0.433 . . . . 0.14999999999999999 109.832 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.577 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 72.3 m -126.87 145.85 50.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.361 0.6 . . . . 0.10000000000000001 112.17 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -74.96 139.08 42.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.167 -0.924 . . . . 1.26 111.113 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -91.32 145.0 25.01 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.915 -0.402 . . . . 3.3500000000000001 109.915 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 34.9 m -51.46 -32.1 25.74 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.466 0.543 . . . . 0.26000000000000001 112.466 -178.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -83.58 4.6 27.52 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.04 0.385 . . . . 1.71 112.04 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.15 136.94 8.02 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.668 -0.777 . . . . 0.16 113.106 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 119.55 -174.58 15.52 Favored Glycine 0 N--CA 1.451 -0.337 0 N-CA-C 110.94 -0.864 . . . . 0.16 110.94 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -130.63 140.88 50.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.383 0.592 . . . . 0.75 111.032 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -154.16 131.04 10.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.139 -0.482 . . . . 1.1599999999999999 110.421 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.57 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.3 t -93.71 134.67 35.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.14999999999999999 111.118 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.401 ' OG ' HD12 ' A' ' 48' ' ' LEU . 53.1 p -120.19 158.03 27.83 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.191 -0.459 . . . . 0.32000000000000001 110.446 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.49 144.48 49.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.977 0.418 . . . . 1.0700000000000001 111.045 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.798 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.0 tt -145.79 143.16 21.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.939 -0.573 . . . . 0.72999999999999998 111.448 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -98.88 120.14 38.83 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.383 -0.371 . . . . 1.1799999999999999 110.935 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.667 ' HB3' HD12 ' A' ' 91' ' ' ILE . 11.4 mt -100.28 -3.59 31.06 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.51 0.93 . . . . 0.19 113.51 -178.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.835 ' OD1' HG22 ' A' ' 5' ' ' ILE . 50.3 t30 -44.69 -28.97 0.68 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.038 0.381 . . . . 0.23999999999999999 111.755 -178.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' SER . . . . . 0.407 ' O ' ' O ' ' A' ' 1' ' ' LEU . 37.1 m -84.02 -39.3 19.81 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.575 0.583 . . . . 1.0700000000000001 112.575 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.78 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.0 m -73.24 -49.22 39.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.946 0.721 . . . . 0.20000000000000001 112.946 -178.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.667 HD12 ' HB3' ' A' ' 87' ' ' LEU . 2.7 mt -85.07 147.58 5.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.655 0.264 . . . . 0.14000000000000001 110.662 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 23.5 tt0 -137.49 163.04 32.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.817 -0.438 . . . . 1.1699999999999999 109.817 -179.136 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -107.12 100.23 9.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.22 0.533 . . . . 0.23000000000000001 110.184 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 18.8 t -100.37 98.56 7.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.45 -0.795 . . . . 0.16 111.825 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.3 t0 53.44 33.66 16.47 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.108 0.41 . . . . 0.23999999999999999 112.108 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.76 27.03 15.24 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.638 -0.792 . . . . 0.12 113.08 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -141.85 134.04 27.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.693 0.282 . . . . 1.23 110.95 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.487 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 62.6 mt -74.24 122.7 23.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.445 -0.343 . . . . 0.19 110.673 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -122.65 143.07 50.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.976 0.417 . . . . 1.5 111.488 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -90.0 78.57 6.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.924 -0.58 . . . . 1.4399999999999999 110.734 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.192 -0.909 . . . . 3.8399999999999999 110.849 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.154 0 N-CA-C 112.658 -0.177 . . . . 0.0 112.658 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 6.9 mt 61.39 32.35 19.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.762 0.315 . . . . 0.0 110.944 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 145.88 134.51 2.67 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.516 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -154.12 84.38 1.14 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.622 0.249 . . . . 0.0 111.13 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.41 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 15.0 p90 -93.04 -40.75 10.35 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.745 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.0 tp -61.86 -21.28 25.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.609 0.242 . . . . 0.0 111.379 -179.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.49 -26.73 51.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.7 0.286 . . . . 0.0 110.615 179.05 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.0 p -118.75 18.73 13.32 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.814 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.0 m -135.69 153.87 51.46 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.895 0.379 . . . . 0.0 111.165 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 ptm85 -131.46 172.72 11.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.994 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 48.87 58.14 5.65 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.621 HG21 ' CD1' ' A' ' 5' ' ' ILE . 43.9 p -79.46 134.31 36.53 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.603 ' O ' HD12 ' A' ' 19' ' ' LEU . 27.1 pt20 -158.09 163.68 37.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.605 -179.032 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.707 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.42 135.9 38.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.244 0.545 . . . . 0.0 110.944 -179.96 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.8 144.84 47.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.141 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.58 -152.8 29.93 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 119.739 -1.22 . . . . 0.0 111.486 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.47 -36.86 18.8 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -140.86 35.74 1.77 Allowed 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -178.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -115.87 148.06 40.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.135 0.493 . . . . 0.0 111.951 178.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.806 ' CB ' HD11 ' A' ' 37' ' ' LEU . 8.6 tp -121.57 124.95 45.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.184 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.09 144.08 48.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.99 0.424 . . . . 0.0 110.206 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.55 172.47 16.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.851 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -112.02 134.86 53.31 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 176.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 82.5 m -130.71 135.07 47.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.206 0.527 . . . . 0.0 112.337 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.06 135.15 53.22 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.438 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.474 HG22 ' O ' ' A' ' 95' ' ' ASP . 79.8 p -84.84 -177.7 6.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.366 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -60.37 -30.64 69.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.768 0.318 . . . . 0.0 111.361 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.06 10.34 8.31 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 66.41 36.05 5.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.11 0.481 . . . . 0.0 111.117 -178.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -115.94 136.32 53.15 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -93.98 125.08 38.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.122 0.487 . . . . 0.0 112.19 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.9 m -131.46 148.5 32.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.623 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.4 m -69.85 136.59 50.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.219 0.533 . . . . 0.0 111.809 -178.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.9 t -143.24 161.64 37.75 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.03 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -142.92 156.89 44.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.483 0.658 . . . . 0.0 112.226 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.458 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -138.08 126.32 30.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.894 -1.048 . . . . 0.0 108.612 179.447 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -89.28 118.76 29.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.793 0.33 . . . . 0.0 110.761 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.806 HD11 ' CB ' ' A' ' 19' ' ' LEU . 4.0 mp -87.99 -14.66 38.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.329 -0.396 . . . . 0.0 112.028 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.438 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.9 p-10 -57.68 -44.39 85.76 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -178.285 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.438 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 5.9 p30 -92.6 -10.94 35.65 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 122.089 -0.382 . . . . 0.0 111.542 178.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.466 ' HB3' HD12 ' A' ' 41' ' ' ILE . 19.6 m-70 -96.69 -66.34 0.91 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.609 HD12 ' N ' ' A' ' 41' ' ' ILE . 2.1 mp -81.09 150.47 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.001 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.466 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.1 172.14 13.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.809 -178.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.661 HD22 ' HA2' ' A' ' 46' ' ' GLY . 27.7 t-20 -112.75 111.56 22.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.323 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 41.4 mm -110.82 90.25 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.383 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 66.93 38.97 3.44 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.932 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.661 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 83.01 5.38 89.34 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.778 179.668 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.4 m -115.96 135.23 54.17 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.912 0.356 . . . . 0.0 110.522 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 19.4 mt -77.39 118.84 20.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.688 0.756 . . . . 0.0 111.58 -177.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -137.97 162.95 32.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.493 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.734 ' CE2' HG11 ' A' ' 90' ' ' VAL . 8.5 m-90 -86.79 121.05 28.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.869 0.366 . . . . 0.0 111.28 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.467 ' O ' ' N ' ' A' ' 53' ' ' SER . 11.8 tt0 -174.89 143.06 0.76 Allowed Pre-proline 0 N--CA 1.464 0.267 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.491 -179.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -62.98 68.37 0.14 Allowed 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.336 2.024 . . . . 0.0 112.994 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.467 ' N ' ' O ' ' A' ' 51' ' ' GLN . 4.7 p -158.96 131.73 6.97 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.422 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.71 109.96 15.74 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -177.543 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -48.0 -30.49 4.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.927 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 62.8 p -49.92 -19.04 0.61 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -179.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 53.5 mm-40 -61.43 -29.41 69.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.576 0.227 . . . . 0.0 110.895 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 4.9 p -127.95 0.3 5.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.537 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -113.09 148.09 35.97 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.39 0.614 . . . . 0.0 112.295 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -142.07 157.58 44.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.831 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 64.02 44.87 4.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.99 0.424 . . . . 0.0 110.342 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.707 ' O ' HD22 ' A' ' 13' ' ' LEU . 10.2 m -69.16 138.17 53.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.5 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -145.28 153.21 41.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.529 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.406 ' CD1' ' HB2' ' A' ' 19' ' ' LEU . 27.5 mt -129.55 139.4 51.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.193 0.521 . . . . 0.0 111.537 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -133.39 107.92 8.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.172 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.15 -119.73 11.03 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.44 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.2 p -102.91 -3.08 26.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.004 0.402 . . . . 0.0 111.87 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.46 HG13 ' O ' ' A' ' 85' ' ' ILE . 8.0 t -102.32 138.87 24.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-O 121.097 0.475 . . . . 0.0 111.962 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.713 HD22 HD22 ' A' ' 37' ' ' LEU . 3.1 tp -100.43 126.17 46.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.914 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.663 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.4 m -116.85 124.41 49.45 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.231 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.3 t -152.37 153.85 34.45 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 10.4 m -93.41 125.9 38.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.818 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.491 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 90.8 m -124.91 143.95 50.59 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -178.223 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . 0.413 ' HG3' ' CE1' ' A' ' 80' ' ' TYR . 16.2 tt0 -74.34 136.14 42.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.894 178.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 6.4 mtm180 -91.83 142.55 27.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.685 0.279 . . . . 0.0 110.68 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.8 m -51.9 -27.09 11.73 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.7 -179.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -83.12 2.59 34.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.786 0.327 . . . . 0.0 111.284 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.86 135.85 6.49 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.542 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.27 -170.03 13.11 Favored Glycine 0 C--N 1.318 -0.418 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 -178.502 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.413 ' CE1' ' HG3' ' A' ' 74' ' ' GLU . 18.3 m-85 -131.86 143.18 49.98 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 117.411 0.605 . . . . 0.0 111.56 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -153.94 130.07 10.36 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.471 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.6 t -91.86 135.3 34.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.686 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 85.9 p -124.23 158.05 33.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.256 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.75 144.41 49.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.844 0.354 . . . . 0.0 111.092 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.729 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.5 tt -144.71 142.56 23.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.291 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -97.63 117.79 32.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.646 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.613 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 5.8 mt -98.54 -5.16 32.66 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.745 ' OD1' HG22 ' A' ' 5' ' ' ILE . 42.1 t30 -45.37 -27.99 0.78 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 122.151 -0.343 . . . . 0.0 111.754 -178.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.71 -40.38 25.43 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.734 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.3 m -73.47 -53.15 18.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.598 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.1 mp -80.85 147.95 5.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.972 0.415 . . . . 0.0 111.202 -179.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' A' ' 99' ' ' LYS . 15.2 tt0 -138.07 164.63 28.62 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.838 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -106.42 99.66 9.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.309 0.576 . . . . 0.0 110.365 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 39.2 t -98.98 97.14 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.92 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.474 ' O ' HG22 ' A' ' 25' ' ' THR . 23.2 t0 53.98 31.8 14.19 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.68 0.276 . . . . 0.0 111.565 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.11 28.22 11.15 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.794 -0.717 . . . . 0.0 113.414 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 42.5 m -139.76 136.35 34.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.882 0.372 . . . . 0.0 111.138 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.409 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 77.0 mt -74.04 119.36 18.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.648 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.418 ' O ' ' N ' ' A' ' 92' ' ' GLU . 4.1 mmmt -125.99 137.14 53.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.984 0.421 . . . . 0.0 111.966 -179.136 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.45 ' CD2' ' CE1' ' A' ' 40' ' ' HIS . 19.5 t80 -78.41 148.81 33.49 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.314 179.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.432 ' N ' ' CD1' ' A' ' 100' ' ' TYR . 23.5 tt0 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.309 -0.853 . . . . 0.0 111.031 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 112.494 -0.243 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.507 HD23 ' O ' ' A' ' 1' ' ' LEU . 2.3 tt -153.78 -47.3 0.09 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.738 0.304 . . . . 0.0 111.018 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 149.07 123.46 1.27 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.804 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -151.89 84.39 1.28 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.851 0.358 . . . . 0.0 110.711 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.453 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 16.1 p90 -88.45 -42.32 12.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.545 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.792 HG22 ' OD1' ' A' ' 88' ' ' ASN . 6.4 tp -62.24 -21.27 26.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.615 0.245 . . . . 0.0 111.389 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -76.66 -27.33 55.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.742 0.306 . . . . 0.0 111.033 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 50.1 p -118.9 18.37 13.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.664 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 77.8 m -131.42 155.08 47.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.057 0.456 . . . . 0.0 111.545 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -132.51 172.95 11.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.889 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.0 p30 48.82 58.1 5.68 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.566 HG21 ' CD1' ' A' ' 5' ' ' ILE . 40.2 p -79.49 130.77 35.71 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.653 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.4 pt20 -157.05 163.26 39.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.417 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.747 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.86 136.42 38.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.822 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.45 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.06 145.52 46.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.345 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.27 -152.28 33.78 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.788 -1.196 . . . . 0.0 111.325 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.19 -37.17 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.461 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.63 35.36 1.63 Allowed 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.8 OUTLIER -113.71 147.9 37.36 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.937 0.399 . . . . 0.0 111.662 179.016 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.819 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.4 tp -120.11 123.61 43.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.397 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.63 143.69 48.54 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.49 172.51 16.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.214 -178.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -110.07 134.12 52.49 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.484 ' SG ' HD21 ' A' ' 98' ' ' LEU . 75.0 m -130.67 132.91 45.68 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.385 -0.526 . . . . 0.0 112.082 -178.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.5 ptpt -66.93 136.33 55.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.357 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.413 HG22 ' O ' ' A' ' 95' ' ' ASP . 71.2 p -85.21 -176.91 6.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.49 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -62.29 -29.71 70.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.229 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.96 10.35 8.1 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 66.9 38.36 3.68 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.12 0.486 . . . . 0.0 111.511 -178.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.466 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 3.0 mm-40 -118.28 135.92 54.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.979 178.071 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -93.07 124.85 37.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.8 0.333 . . . . 0.0 111.444 -178.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.5 m -130.99 151.78 36.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.896 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.8 p -71.5 134.29 46.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.173 0.511 . . . . 0.0 111.916 -178.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 t -144.17 161.37 39.04 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.368 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -143.7 156.64 44.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.298 0.571 . . . . 0.0 111.893 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.485 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -136.57 127.59 42.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.302 -0.863 . . . . 0.0 108.977 179.608 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -87.49 116.98 25.98 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.699 0.285 . . . . 0.0 111.531 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.897 HD22 HD22 ' A' ' 69' ' ' LEU . 3.9 mp -87.59 -14.84 39.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.91 179.106 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.433 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -56.59 -48.24 77.82 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.297 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.419 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -90.96 -10.08 43.68 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 122.13 -0.356 . . . . 0.0 111.384 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 -95.21 -62.98 1.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.603 HD11 HD22 ' A' ' 87' ' ' LEU . 22.7 mm -80.73 151.04 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.839 178.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.56 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.91 172.23 12.97 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.107 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.57 HD22 ' HA2' ' A' ' 46' ' ' GLY . 23.5 t-20 -112.18 108.85 18.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.682 -179.413 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 50.8 mm -109.64 89.78 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.315 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 43.9 t0 66.21 38.05 4.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.332 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.57 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 85.25 0.63 88.55 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.182 179.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.4 m -112.08 137.36 50.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.924 0.393 . . . . 0.0 111.003 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 26.8 mt -76.95 117.5 18.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.705 0.764 . . . . 0.0 111.565 -177.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -138.44 162.86 33.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.836 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.803 ' CH2' HD11 ' A' ' 85' ' ' ILE . 4.0 m-90 -84.86 123.13 30.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.039 0.447 . . . . 0.0 111.865 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.56 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -172.17 147.17 1.8 Allowed Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.255 -179.739 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.419 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 51.6 Cg_endo -69.65 63.7 1.73 Allowed 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.231 1.954 . . . . 0.0 112.305 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.402 ' O ' ' O ' ' A' ' 41' ' ' ILE . 3.1 p -158.28 135.15 9.79 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.32 179.111 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.01 109.71 15.86 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.461 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 37.6 p90 -48.92 -29.4 4.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.466 178.28 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.3 p -48.31 -17.89 0.18 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.883 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -63.75 -29.01 70.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.623 0.249 . . . . 0.0 111.39 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.2 p -127.51 -0.94 6.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.473 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.7 m -110.53 147.97 33.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.202 0.525 . . . . 0.0 111.931 -178.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.7 p90 -142.29 157.61 44.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.045 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.6 m120 64.14 47.29 3.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.947 0.403 . . . . 0.0 110.856 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.747 ' O ' HD22 ' A' ' 13' ' ' LEU . 6.1 m -70.79 135.03 47.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.689 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.12 150.36 42.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.575 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.497 HG13 ' HB2' ' A' ' 13' ' ' LEU . 33.6 mt -128.68 138.76 53.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.376 0.608 . . . . 0.0 111.891 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -136.09 108.19 7.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.16 -0.927 . . . . 0.0 108.963 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.441 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 69.53 -121.36 11.01 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.442 -0.885 . . . . 0.0 111.449 -178.638 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.45 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.2 p -101.68 -4.17 26.98 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.52 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.2 t -101.41 140.37 20.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.033 0.444 . . . . 0.0 111.99 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.897 HD22 HD22 ' A' ' 37' ' ' LEU . 7.7 tp -102.49 125.97 49.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.349 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.504 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -116.11 124.69 51.0 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.5 t -151.79 153.77 34.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.704 0.287 . . . . 0.0 111.485 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 18.8 m -94.83 126.22 40.01 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 178.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.548 ' HB3' HD22 ' A' ' 43' ' ' ASN . 88.1 m -125.95 144.98 50.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.351 0.596 . . . . 0.0 112.37 -178.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -74.26 137.43 42.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.914 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -91.93 142.5 27.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.665 0.269 . . . . 0.0 110.446 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 56.4 m -52.14 -26.8 12.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.539 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -83.43 2.03 38.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.579 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.45 134.99 6.87 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.774 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.09 -169.14 12.76 Favored Glycine 0 C--N 1.319 -0.41 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -131.04 143.31 50.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 117.337 0.568 . . . . 0.0 111.308 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -153.9 128.85 9.53 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.167 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.7 t -91.97 134.71 34.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.495 -179.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 21.8 p -121.96 158.03 29.97 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.276 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.6 p -123.2 145.02 48.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.878 0.371 . . . . 0.0 110.978 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.803 HD11 ' CH2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -146.99 145.03 19.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.628 -179.822 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.776 ' N ' HD13 ' A' ' 85' ' ' ILE . 46.1 t0 -98.56 117.91 34.07 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.244 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.603 HD22 HD11 ' A' ' 41' ' ' ILE . 6.3 mt -100.1 -6.47 26.26 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.242 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.792 ' OD1' HG22 ' A' ' 5' ' ' ILE . 36.5 t30 -45.01 -27.04 0.5 Allowed 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -178.392 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.7 m -80.26 -38.34 31.11 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.669 HG11 ' CZ2' ' A' ' 50' ' ' TRP . 3.2 m -75.49 -51.83 19.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -178.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.531 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -81.57 147.49 6.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.034 0.445 . . . . 0.0 111.247 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.44 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 23.1 tt0 -139.08 167.0 23.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.266 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -106.26 99.56 9.14 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.18 0.514 . . . . 0.0 110.378 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.404 ' CG2' ' HG3' ' A' ' 99' ' ' LYS . 58.6 t -97.95 96.51 5.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.999 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.413 ' O ' HG22 ' A' ' 25' ' ' THR . 28.5 t0 53.45 32.84 14.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.632 0.253 . . . . 0.0 111.515 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.44 28.38 11.59 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.831 -0.7 . . . . 0.0 113.345 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.7 m -141.1 135.06 30.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 0.0 111.009 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.484 HD21 ' SG ' ' A' ' 23' ' ' CYS . 54.1 mt -73.39 119.94 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.759 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.3 mttm -123.81 133.95 53.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.467 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.404 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 36.6 t80 -79.0 -32.06 45.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.34 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.871 179.785 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.16 0 N-CA-C 112.436 -0.265 . . . . 0.0 112.436 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 16.5 tp -144.17 108.72 4.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.82 0.343 . . . . 0.0 110.81 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 82.28 -106.31 2.68 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.808 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.6 mmtm 62.48 66.46 0.78 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.841 0.353 . . . . 0.0 110.988 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.46 ' CE2' ' HA ' ' A' ' 88' ' ' ASN . 22.8 p90 -91.39 -40.39 11.47 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.617 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.961 HG22 ' ND2' ' A' ' 88' ' ' ASN . 3.8 tp -64.43 -18.16 22.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.674 0.274 . . . . 0.0 111.272 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.31 -24.19 60.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.873 0.368 . . . . 0.0 110.577 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.4 p -118.46 -3.77 10.9 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.682 179.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.8 m -108.19 152.58 24.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.966 0.412 . . . . 0.0 111.482 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -132.09 172.42 12.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.751 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.403 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 6.2 p-10 48.43 58.05 5.6 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.799 HG21 ' CD1' ' A' ' 5' ' ' ILE . 66.9 p -79.67 132.75 36.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.319 178.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.629 ' O ' HD12 ' A' ' 19' ' ' LEU . 19.6 pt20 -158.71 163.95 36.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.192 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.692 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.42 136.38 37.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.147 0.499 . . . . 0.0 110.863 -179.666 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.22 143.81 47.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.098 179.237 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.29 -152.78 32.9 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 119.89 -1.147 . . . . 0.0 111.462 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -85.83 -37.09 19.59 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.458 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -141.43 36.23 1.67 Allowed 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 8.2 mp0 -115.83 146.67 41.78 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.808 0.337 . . . . 0.0 111.81 178.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.764 ' CB ' HD11 ' A' ' 37' ' ' LEU . 10.7 tp -119.86 124.76 46.86 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.21 142.66 47.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.2 172.72 16.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.189 -178.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -115.45 133.54 55.93 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 177.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.7 m -130.77 135.66 47.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.077 0.465 . . . . 0.0 111.62 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.7 ptpt -66.88 136.93 56.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.675 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.637 HG22 ' O ' ' A' ' 95' ' ' ASP . 42.4 p -84.91 -176.92 6.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.696 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.8 mmt-85 -61.48 -30.48 70.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.801 0.334 . . . . 0.0 110.995 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.12 9.17 9.05 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 66.99 38.81 3.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.317 0.579 . . . . 0.0 111.099 -178.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.434 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 60.8 mt-30 -119.42 134.89 54.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.283 -0.872 . . . . 0.0 108.872 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.406 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 43.4 m-85 -93.09 124.65 37.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.972 0.415 . . . . 0.0 111.544 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.1 m -130.36 153.58 39.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.811 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.24 134.46 44.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.27 0.557 . . . . 0.0 112.186 -178.478 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.8 t -143.59 161.21 39.08 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.28 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.0 ttmt -142.86 156.73 44.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.341 0.591 . . . . 0.0 111.887 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.482 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.03 128.05 49.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.017 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -88.33 115.42 25.82 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.626 0.25 . . . . 0.0 111.296 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.967 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -86.59 -15.44 39.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.344 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.422 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -57.09 -45.22 83.53 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 -178.757 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -91.89 -10.41 39.73 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.494 ' CD2' ' CD2' ' A' ' 100' ' ' TYR . 8.9 m80 -98.33 -63.33 1.14 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.533 HD13 ' CD1' ' A' ' 50' ' ' TRP . 20.6 mm -80.6 147.73 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.952 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.07 172.24 12.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.526 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.619 HD22 ' HA2' ' A' ' 46' ' ' GLY . 26.6 t-20 -113.11 111.72 22.61 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.164 -179.189 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.78 HD13 ' HB2' ' A' ' 49' ' ' LYS . 3.0 mp -112.01 89.34 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.909 0.385 . . . . 0.0 111.032 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.7 t0 67.78 38.26 2.97 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.258 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.619 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 85.75 0.88 87.57 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.564 -0.827 . . . . 0.0 113.424 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.4 m -110.72 135.41 51.36 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.307 0.554 . . . . 0.0 110.893 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.7 mt -77.63 118.76 20.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.454 0.645 . . . . 0.0 111.249 -178.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.78 ' HB2' HD13 ' A' ' 44' ' ' ILE . 28.2 mttt -138.99 163.24 32.89 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.514 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.727 ' CE2' HG11 ' A' ' 90' ' ' VAL . 7.7 m-90 -85.89 118.68 25.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.133 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.44 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 43.0 tt0 -174.66 143.14 0.8 Allowed Pre-proline 0 N--CA 1.465 0.31 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.005 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.403 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 28.4 Cg_endo -64.55 74.67 0.2 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.093 1.862 . . . . 0.0 113.164 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -165.75 135.19 3.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.348 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.464 ' N ' ' OD1' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.69 109.31 15.98 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -177.688 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 38.6 p90 -50.0 -28.41 6.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.808 178.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.1 p -49.32 -16.99 0.21 Allowed 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -63.92 -29.62 70.78 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 122.16 -0.338 . . . . 0.0 111.351 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.2 p -128.2 1.04 5.8 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.073 -0.251 . . . . 0.0 111.479 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.4 m -111.81 147.66 35.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.231 0.538 . . . . 0.0 112.095 -178.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -143.63 157.72 44.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.886 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 4.5 m120 64.15 46.33 3.69 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.029 0.442 . . . . 0.0 110.89 -179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.692 ' O ' HD22 ' A' ' 13' ' ' LEU . 35.8 m -70.53 137.6 50.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.097 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.66 151.67 41.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.986 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.477 HG21 HD13 ' A' ' 19' ' ' LEU . 54.4 mt -130.66 138.77 52.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 121.325 0.583 . . . . 0.0 111.889 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -136.03 111.26 9.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.273 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.484 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.82 -121.1 13.65 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.122 -1.037 . . . . 0.0 110.734 -178.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.418 ' HB3' ' HB ' ' A' ' 5' ' ' ILE . 22.5 p -103.07 -3.21 26.25 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.471 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.6 t -100.97 138.19 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 121.028 0.442 . . . . 0.0 111.937 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.967 HD22 HD22 ' A' ' 37' ' ' LEU . 6.8 tp -102.49 124.37 47.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.142 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.465 ' N ' HD12 ' A' ' 69' ' ' LEU . 4.5 m -115.67 126.92 54.75 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 t -152.01 153.86 34.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.768 0.318 . . . . 0.0 111.455 -179.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.2 m -93.9 126.13 38.92 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.497 ' HB3' HD22 ' A' ' 43' ' ' ASN . 74.0 m -126.88 144.93 50.84 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.467 0.651 . . . . 0.0 112.508 -178.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -74.64 137.32 42.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.605 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -90.73 144.72 25.44 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.7 m -51.46 -26.46 8.23 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -83.17 3.07 32.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.634 0.254 . . . . 0.0 111.489 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.32 138.47 7.34 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.089 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.77 -169.83 13.09 Favored Glycine 0 C--N 1.318 -0.448 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -129.5 140.42 51.27 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 117.196 0.498 . . . . 0.0 111.066 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -154.01 128.93 9.49 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.406 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.6 t -93.41 134.87 35.2 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.916 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 37.6 p -121.98 158.3 29.41 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.516 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -122.12 144.52 48.89 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.662 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.653 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.6 tt -145.67 142.58 21.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.605 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -97.38 121.11 38.91 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.078 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.564 ' HB3' HD12 ' A' ' 91' ' ' ILE . 10.2 mt -100.58 -4.16 29.1 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.961 ' ND2' HG22 ' A' ' 5' ' ' ILE . 13.1 t-20 -44.75 -28.44 0.63 Allowed 'General case' 0 N--CA 1.468 0.436 0 O-C-N 122.097 -0.377 . . . . 0.0 111.756 -178.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 49.1 m -81.64 -41.78 20.95 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.727 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.3 m -72.13 -52.75 22.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -177.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.564 HD12 ' HB3' ' A' ' 87' ' ' LEU . 2.6 mp -81.99 145.49 8.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.108 0.48 . . . . 0.0 111.47 -178.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.4 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 9.1 tt0 -135.96 166.25 23.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.062 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -107.95 99.53 8.98 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.27 0.557 . . . . 0.0 110.169 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.2 t -97.63 96.68 5.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.693 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.637 ' O ' HG22 ' A' ' 25' ' ' THR . 22.1 t0 53.42 33.18 15.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.613 0.244 . . . . 0.0 111.599 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.12 28.52 11.67 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.508 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.2 t -140.55 135.33 31.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.901 0.351 . . . . 0.0 110.875 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.429 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 55.6 mt -74.27 120.47 19.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.869 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -127.01 138.09 53.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.892 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.494 ' CD2' ' CD2' ' A' ' 40' ' ' HIS . 15.0 t80 -86.68 133.06 33.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.845 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.146 -0.931 . . . . 0.0 111.269 -179.46 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 N-CA-C 112.514 -0.234 . . . . 0.0 112.514 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 8.1 tp -100.1 159.62 14.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.748 0.309 . . . . 0.0 110.759 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -63.18 140.62 45.41 Favored Glycine 0 CA--C 1.518 0.231 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.864 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.72 83.77 1.29 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.734 0.302 . . . . 0.0 110.88 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.448 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 17.0 p90 -90.97 -41.85 10.88 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.704 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.952 HG22 ' ND2' ' A' ' 88' ' ' ASN . 6.8 tp -61.83 -22.56 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-O 120.679 0.276 . . . . 0.0 111.498 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -75.24 -24.53 57.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.069 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.8 p -118.05 -3.69 11.09 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 58.2 m -111.14 155.17 23.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.882 0.373 . . . . 0.0 111.069 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -130.22 172.43 11.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.79 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 48.08 59.52 4.19 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.763 HG21 ' CD1' ' A' ' 5' ' ' ILE . 16.6 p -78.78 132.21 36.82 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.766 ' O ' HD12 ' A' ' 19' ' ' LEU . 18.4 pt20 -157.43 163.62 38.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.938 0.399 . . . . 0.0 111.79 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.743 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.47 136.49 37.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.706 179.601 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.86 146.48 46.53 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.223 179.11 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.64 -153.15 25.12 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 119.771 -1.204 . . . . 0.0 111.365 -178.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.7 m -85.52 -36.95 20.18 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -140.81 36.11 1.79 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 5.0 mp0 -115.23 149.64 37.41 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.153 0.501 . . . . 0.0 112.172 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.801 ' CB ' HD11 ' A' ' 37' ' ' LEU . 19.4 tp -122.45 123.06 40.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.239 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.461 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . . . -119.02 143.98 46.79 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.47 172.82 15.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.302 -178.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -110.98 133.99 52.95 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 61.4 m -130.8 132.08 45.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.052 0.453 . . . . 0.0 111.92 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.11 137.0 56.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.411 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.421 HG22 ' O ' ' A' ' 95' ' ' ASP . 53.3 p -87.3 -177.74 6.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.516 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.9 mmt85 -62.2 -28.94 70.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.557 0.218 . . . . 0.0 111.288 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.36 8.39 9.34 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 66.66 38.0 4.15 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.263 0.554 . . . . 0.0 110.653 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -118.88 136.08 54.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.977 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -92.69 124.74 36.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.931 0.396 . . . . 0.0 111.452 -178.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.2 m -129.81 148.67 33.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.417 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.5 t -71.61 137.15 47.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.179 0.514 . . . . 0.0 111.946 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 t -145.97 162.35 38.01 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.643 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.461 ' HG3' ' HB2' ' A' ' 20' ' ' ALA . 28.8 ttpt -143.88 155.84 44.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.316 0.579 . . . . 0.0 112.043 -179.028 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.463 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.26 127.77 47.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -89.1 118.6 28.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.72 0.295 . . . . 0.0 110.863 -177.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.801 HD11 ' CB ' ' A' ' 19' ' ' LEU . 3.7 mp -88.96 -16.11 32.57 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.852 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.401 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.1 p-10 -56.57 -43.93 80.47 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -178.372 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.401 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.3 OUTLIER -92.71 -10.59 36.58 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 122.201 -0.312 . . . . 0.0 111.601 178.92 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 5.9 m80 -96.65 -64.92 1.0 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.626 HD11 HD22 ' A' ' 87' ' ' LEU . 23.2 mm -80.93 148.49 5.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.734 178.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -138.52 172.26 13.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.84 -179.626 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.412 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 30.0 t30 -111.96 109.59 19.45 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.464 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 37.8 mm -109.54 88.98 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.678 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 49.8 t0 67.17 39.68 3.03 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.255 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.48 0.75 88.11 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.829 -0.7 . . . . 0.0 113.439 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 39.1 m -113.78 138.23 50.54 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.033 0.444 . . . . 0.0 111.429 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.6 mt -77.17 117.17 18.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.645 0.736 . . . . 0.0 111.118 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 46.4 mttt -135.84 162.49 32.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.859 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.825 ' CH2' HD11 ' A' ' 85' ' ' ILE . 4.9 m-90 -85.33 118.04 24.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.966 0.412 . . . . 0.0 111.149 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.417 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 29.2 tt0 -173.04 142.25 1.02 Allowed Pre-proline 0 N--CA 1.465 0.324 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.705 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.4 ' HD2' ' HG3' ' A' ' 51' ' ' GLN . 34.3 Cg_endo -64.97 73.29 0.23 Allowed 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 121.968 1.779 . . . . 0.0 112.455 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.408 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -162.85 134.57 5.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.69 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.23 109.34 16.42 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.412 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 29.8 p90 -48.5 -30.74 5.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.876 178.477 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.2 p -49.14 -17.82 0.26 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -178.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -62.02 -28.66 69.74 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.136 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.412 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.5 p -128.56 -0.09 5.55 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.387 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.2 m -110.69 148.8 31.52 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -141.1 156.97 45.9 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.248 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 62.96 46.53 4.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.98 0.419 . . . . 0.0 110.632 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.743 ' O ' HD22 ' A' ' 13' ' ' LEU . 73.0 m -69.31 135.96 51.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.188 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.403 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -143.16 152.57 41.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.673 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.52 HD13 HD13 ' A' ' 19' ' ' LEU . 52.4 mt -129.83 140.1 49.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.284 0.564 . . . . 0.0 111.905 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -135.23 108.83 7.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.257 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.449 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.18 -120.95 14.55 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.445 -0.883 . . . . 0.0 111.012 -178.435 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.455 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.5 p -100.85 -3.17 30.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.144 0.472 . . . . 0.0 111.858 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.568 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.3 t -101.95 138.51 25.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-O 121.01 0.433 . . . . 0.0 111.922 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.784 HD22 HD22 ' A' ' 37' ' ' LEU . 6.6 tp -101.13 124.92 47.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.394 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.462 ' N ' HD12 ' A' ' 69' ' ' LEU . 2.9 m -115.16 125.12 53.05 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.2 t -151.94 154.09 35.38 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.616 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.9 m -93.88 125.81 38.72 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 84.8 m -127.95 145.3 51.01 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 -178.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -75.63 136.47 40.46 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.585 178.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -92.21 146.01 24.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.669 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.3 m -51.79 -27.38 12.12 Favored 'General case' 0 N--CA 1.462 0.155 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -82.95 2.3 35.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.524 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.95 137.79 6.83 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.417 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.19 -169.46 12.89 Favored Glycine 0 C--N 1.319 -0.396 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -178.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -132.03 142.18 49.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.282 0.541 . . . . 0.0 111.15 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -154.32 128.28 8.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.124 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.0 OUTLIER -91.61 134.16 34.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.264 -179.479 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 p -119.29 158.27 26.39 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.588 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 4.4 p -120.15 142.75 48.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.818 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.841 HD13 ' N ' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -148.07 144.95 18.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.529 179.736 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.841 ' N ' HD13 ' A' ' 85' ' ' ILE . 11.0 t70 -100.79 120.73 40.54 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.585 -179.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.626 HD22 HD11 ' A' ' 41' ' ' ILE . 12.1 mt -102.02 -3.25 27.98 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.952 ' ND2' HG22 ' A' ' 5' ' ' ILE . 6.3 t-20 -45.0 -26.96 0.49 Allowed 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.2 m -80.22 -42.17 23.79 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.684 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.7 m -71.63 -52.9 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -178.126 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.653 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.2 mp -80.53 147.68 6.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.945 0.402 . . . . 0.0 111.342 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.413 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 12.9 tt0 -139.46 167.2 22.63 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.473 -178.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -105.8 99.5 9.1 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.997 0.427 . . . . 0.0 110.639 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.2 t -100.34 94.87 3.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.787 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.421 ' O ' HG22 ' A' ' 25' ' ' THR . 20.5 t0 55.36 32.58 19.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.674 0.273 . . . . 0.0 111.448 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.28 27.87 14.57 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.915 -0.659 . . . . 0.0 113.204 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.3 t -139.05 134.02 32.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.73 0.3 . . . . 0.0 111.059 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.425 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 78.2 mt -72.74 118.78 16.09 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.945 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -124.74 140.5 52.88 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -84.8 143.46 29.09 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.014 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.32 -0.848 . . . . 0.0 110.811 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.221 0 N-CA-C 112.472 -0.251 . . . . 0.0 112.472 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 31.9 mt -62.53 -52.0 65.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.77 0.319 . . . . 0.0 110.86 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.54 -82.64 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.662 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.433 ' HD3' ' ND2' ' A' ' 88' ' ' ASN . 24.5 mmtt 65.92 70.71 0.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.968 0.413 . . . . 0.0 110.681 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.44 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 18.3 p90 -91.85 -38.75 12.14 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.349 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.802 HG22 ' OD1' ' A' ' 88' ' ' ASN . 6.7 tp -66.24 -13.18 15.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -77.54 -26.82 51.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.891 0.377 . . . . 0.0 110.878 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.2 p -118.56 0.34 11.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.528 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 76.0 m -112.31 153.44 27.21 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 121.015 0.436 . . . . 0.0 111.047 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.8 ptt180 -132.57 172.6 12.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.989 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 48.91 58.0 5.82 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.655 HG21 ' CD1' ' A' ' 5' ' ' ILE . 8.4 p -79.32 131.64 36.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.979 178.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.753 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.8 pt20 -155.97 163.01 40.27 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.4 -179.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.751 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.42 135.79 38.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.546 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.86 144.34 47.43 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.272 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.38 -151.71 31.34 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 119.799 -1.191 . . . . 0.0 111.3 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.65 -37.06 18.38 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -140.54 35.44 1.83 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.4 mp0 -115.15 146.89 40.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.059 0.457 . . . . 0.0 111.781 179.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.808 ' CB ' HD11 ' A' ' 37' ' ' LEU . 14.6 tp -122.04 124.25 43.52 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.014 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.81 144.07 46.54 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.935 0.398 . . . . 0.0 110.141 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.31 172.35 16.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.17 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -114.57 134.05 55.34 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 177.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.431 ' SG ' HD21 ' A' ' 98' ' ' LEU . 55.7 m -130.57 134.15 46.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.281 0.563 . . . . 0.0 111.894 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.2 ptpt -66.04 137.48 57.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.423 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.635 HG22 ' O ' ' A' ' 95' ' ' ASP . 66.0 p -85.9 -176.43 5.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.644 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -62.93 -30.56 71.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.231 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.81 9.68 7.61 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 66.88 37.67 3.94 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.132 0.492 . . . . 0.0 111.425 -178.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.442 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 54.4 mt-30 -117.25 137.69 52.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.009 177.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -94.85 125.06 39.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.859 0.361 . . . . 0.0 111.849 -178.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 m -131.04 151.05 35.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.0 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.7 p -71.92 135.8 46.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.246 0.546 . . . . 0.0 111.876 -178.816 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.4 t -143.26 161.42 38.33 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.214 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.4 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 13.4 ttmt -142.2 156.1 45.31 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.411 0.624 . . . . 0.0 111.933 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.422 HG23 ' O ' ' A' ' 35' ' ' ILE . 1.3 tp -138.42 125.0 26.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.115 -0.948 . . . . 0.0 108.818 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -86.8 119.13 26.7 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.677 0.275 . . . . 0.0 111.153 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.856 HD22 HD22 ' A' ' 69' ' ' LEU . 4.4 mp -87.99 -16.0 34.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.634 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.444 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -57.69 -44.81 86.11 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.076 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.444 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.4 OUTLIER -91.76 -10.4 40.11 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 122.106 -0.371 . . . . 0.0 111.061 179.285 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.438 ' HB3' HD12 ' A' ' 41' ' ' ILE . 23.6 m-70 -97.87 -68.43 0.8 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.623 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.7 mp -78.59 150.67 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.287 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.439 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.09 172.58 12.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.953 -179.259 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.646 HD22 ' HA2' ' A' ' 46' ' ' GLY . 20.7 t-20 -111.34 109.45 19.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.083 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 33.3 mm -109.88 89.69 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.407 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 55.6 t0 68.0 38.78 2.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.259 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.646 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 84.16 0.7 89.61 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.824 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.9 m -112.81 136.94 51.85 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.863 0.363 . . . . 0.0 110.882 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.415 HD22 HG21 ' A' ' 41' ' ' ILE . 13.5 mt -77.41 117.39 18.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.638 0.733 . . . . 0.0 111.281 -178.098 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.1 mttm -137.51 162.7 33.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.721 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.757 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.2 m-90 -87.27 121.89 30.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.087 0.47 . . . . 0.0 111.561 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 53' ' ' SER . 3.2 tp60 -175.06 143.39 0.76 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.873 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.402 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 23.4 Cg_endo -62.41 69.43 0.12 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.208 1.939 . . . . 0.0 112.553 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -160.49 134.75 7.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.834 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.431 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -82.49 108.42 15.88 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.158 0.504 . . . . 0.0 112.027 -178.068 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.44 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 33.4 p90 -47.63 -31.33 4.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.301 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 45.8 p -47.78 -16.25 0.07 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.316 -0.857 . . . . 0.0 113.006 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -64.56 -26.83 68.59 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.559 0.219 . . . . 0.0 111.381 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.0 p -134.01 5.41 3.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.322 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.6 m -115.18 148.98 38.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.228 0.537 . . . . 0.0 111.837 -178.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -142.84 157.63 44.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.968 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.4 m-20 63.34 46.07 4.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.981 0.42 . . . . 0.0 110.954 -179.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.751 ' O ' HD22 ' A' ' 13' ' ' LEU . 43.2 m -69.59 136.02 50.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.496 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.33 151.03 43.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.511 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.514 HG13 ' HB2' ' A' ' 13' ' ' LEU . 52.2 mt -129.81 140.89 47.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.225 0.536 . . . . 0.0 111.728 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -138.13 110.4 7.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.01 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.36 -122.28 14.77 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.269 -0.967 . . . . 0.0 111.101 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.436 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.3 p -101.32 -2.37 31.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.5 t -102.63 138.62 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.012 0.434 . . . . 0.0 112.109 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.856 HD22 HD22 ' A' ' 37' ' ' LEU . 8.7 tp -102.53 126.93 49.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.329 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.446 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -117.56 125.95 51.72 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.4 t -151.83 153.43 34.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.607 0.241 . . . . 0.0 111.16 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 18.5 m -94.2 126.02 39.18 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.527 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 85.4 m -126.45 145.15 50.6 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.281 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -74.51 136.52 42.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.772 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.1 mtm180 -91.72 143.61 26.37 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 69.2 m -51.83 -27.23 11.82 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -83.67 2.28 38.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.65 0.262 . . . . 0.0 111.531 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.81 136.95 7.4 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.911 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.96 -169.73 13.07 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 111.101 -0.8 . . . . 0.0 111.101 -178.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -130.8 142.04 50.38 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 117.304 0.552 . . . . 0.0 111.22 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -154.15 129.13 9.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.517 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -92.75 134.33 35.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.271 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.3 p -122.77 158.18 30.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.377 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 57.8 p -121.01 144.88 48.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.906 0.384 . . . . 0.0 111.059 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.628 HD11 ' CH2' ' A' ' 50' ' ' TRP . 13.5 tt -144.21 143.0 23.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.399 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -96.88 115.86 28.17 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.995 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.605 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 16.1 mt -95.91 -7.19 37.38 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.802 ' OD1' HG22 ' A' ' 5' ' ' ILE . 53.8 t30 -44.7 -27.83 0.54 Allowed 'General case' 0 N--CA 1.467 0.392 0 O-C-N 122.178 -0.326 . . . . 0.0 111.869 -178.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.88 -37.88 26.22 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.757 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -74.36 -53.87 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 -178.181 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.552 HD12 ' HB3' ' A' ' 87' ' ' LEU . 3.0 mp -80.95 147.78 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.05 0.452 . . . . 0.0 111.465 -178.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.424 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 14.4 tt0 -138.07 164.45 29.08 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.852 -178.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 20.8 t30 -106.67 99.72 9.28 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.087 0.47 . . . . 0.0 110.528 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.453 ' HB ' ' CE ' ' A' ' 99' ' ' LYS . 39.1 t -99.86 96.65 5.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.187 179.387 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.635 ' O ' HG22 ' A' ' 25' ' ' THR . 19.2 t0 53.62 33.0 15.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.66 28.79 13.23 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.697 -0.763 . . . . 0.0 113.054 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -141.91 134.33 28.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.746 0.308 . . . . 0.0 110.925 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.431 HD21 ' SG ' ' A' ' 23' ' ' CYS . 49.8 mt -75.06 119.14 18.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.12 0.486 . . . . 0.0 111.51 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.453 ' CE ' ' HB ' ' A' ' 94' ' ' VAL . 0.9 OUTLIER -122.85 153.41 39.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.084 179.589 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -88.27 -61.25 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.928 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.834 -179.926 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.148 0 N-CA-C 112.487 -0.245 . . . . 0.0 112.487 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.21 -59.75 2.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.82 0.343 . . . . 0.0 110.914 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 164.35 149.4 5.77 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.464 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -154.9 85.37 1.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.732 0.301 . . . . 0.0 111.018 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.443 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 19.6 p90 -92.78 -40.8 10.47 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.543 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.779 HG22 ' OD1' ' A' ' 88' ' ' ASN . 7.8 tp -63.02 -19.84 24.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.673 0.273 . . . . 0.0 111.393 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.506 ' OE2' HG23 ' A' ' 5' ' ' ILE . 38.2 mm-40 -78.48 -26.37 46.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.766 0.317 . . . . 0.0 110.726 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.6 p -118.32 13.83 13.71 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.984 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.9 m -129.77 156.2 44.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.933 0.397 . . . . 0.0 111.167 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.34 172.5 12.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.034 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 47.98 58.56 4.95 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.771 HG21 ' CD1' ' A' ' 5' ' ' ILE . 30.0 p -79.06 132.79 36.73 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.655 ' O ' HD12 ' A' ' 19' ' ' LEU . 3.7 pt20 -157.36 163.81 38.22 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.973 0.416 . . . . 0.0 111.453 -179.154 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.769 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.49 136.1 38.4 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.035 -179.835 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.444 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -118.6 143.45 46.79 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.04 -150.75 31.93 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 119.877 -1.154 . . . . 0.0 111.712 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -87.21 -36.62 17.87 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -178.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.425 ' OG ' ' HB3' ' A' ' 38' ' ' ASP . 3.1 p -140.69 35.07 1.8 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 3.0 mp0 -115.45 148.02 39.9 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.205 0.526 . . . . 0.0 112.123 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.816 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.8 tp -122.06 123.83 42.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.319 179.199 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.29 143.61 47.25 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.19 172.33 16.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.081 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -111.27 133.56 53.51 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 86.1 m -131.01 134.2 46.47 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.416 -0.514 . . . . 0.0 112.277 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 5.3 ptpt -67.11 137.42 56.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.728 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.59 HG22 ' O ' ' A' ' 95' ' ' ASP . 36.2 p -86.05 -178.96 6.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.602 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -61.41 -29.13 69.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.709 0.29 . . . . 0.0 111.222 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.16 10.41 8.35 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 66.51 36.33 5.07 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.138 0.494 . . . . 0.0 111.345 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.414 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 4.3 mt-30 -116.42 137.61 52.02 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -93.92 125.3 38.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.945 0.402 . . . . 0.0 111.864 -178.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.4 m -131.0 150.74 34.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.696 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -72.53 135.96 45.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.145 0.498 . . . . 0.0 111.968 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.6 t -143.7 161.38 38.73 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.208 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -141.93 157.24 45.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.509 0.671 . . . . 0.0 112.283 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.535 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.3 tp -138.47 125.79 27.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.076 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -87.88 119.13 27.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.664 0.268 . . . . 0.0 110.998 -178.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.863 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -88.31 -14.54 38.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.5 p-10 -58.49 -43.46 89.02 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.19 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.455 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.9 OUTLIER -92.16 -10.94 36.97 Favored 'General case' 0 N--CA 1.465 0.306 0 O-C-N 122.096 -0.377 . . . . 0.0 111.8 179.568 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.451 ' CE1' ' CD2' ' A' ' 100' ' ' TYR . 38.9 m-70 -97.8 -59.77 1.7 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.628 HD11 HD22 ' A' ' 87' ' ' LEU . 32.5 mm -81.28 146.16 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.575 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.494 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -139.02 170.34 16.16 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.298 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.449 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 29.8 t30 -112.95 109.68 19.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.53 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.2 mm -110.02 89.6 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.069 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.4 t0 68.52 39.43 2.13 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.089 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.28 5.57 89.5 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.864 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 m -115.23 136.42 53.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.793 0.33 . . . . 0.0 110.821 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.585 HD22 HG21 ' A' ' 41' ' ' ILE . 27.8 mt -77.53 116.15 17.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.666 0.746 . . . . 0.0 111.333 -178.312 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 mmtt -136.34 162.63 32.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.192 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.72 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 7.7 m-90 -86.07 123.47 31.41 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.323 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.494 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 2.8 mt-30 -172.03 152.6 2.95 Favored Pre-proline 0 N--CA 1.465 0.323 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.773 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.06 63.26 4.14 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.023 1.815 . . . . 0.0 112.359 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 4.4 p -155.92 135.03 12.11 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.506 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.43 ' ND2' ' N ' ' A' ' 54' ' ' ASN . 0.2 OUTLIER -81.22 109.56 15.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.182 0.515 . . . . 0.0 112.259 -177.956 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -47.3 -30.59 3.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.708 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 81.9 p -48.58 -18.12 0.22 Allowed 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -61.21 -28.07 68.89 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.933 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.449 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 6.1 p -130.7 1.34 4.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.3 m -111.47 149.18 31.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.192 0.52 . . . . 0.0 112.336 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.6 p90 -141.55 156.56 45.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.817 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 63.98 47.22 3.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.884 0.373 . . . . 0.0 111.242 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.769 ' O ' HD22 ' A' ' 13' ' ' LEU . 73.4 m -69.92 134.89 48.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.453 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.72 152.14 43.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.599 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.459 HG13 ' HB2' ' A' ' 13' ' ' LEU . 39.5 mt -128.92 138.06 55.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.4 0.619 . . . . 0.0 112.034 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -133.77 106.46 7.35 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.079 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.31 -121.89 11.96 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.49 -0.862 . . . . 0.0 111.58 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.429 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 24.3 p -99.41 -4.4 31.61 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.458 HG13 ' O ' ' A' ' 85' ' ' ILE . 3.5 t -102.04 140.51 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 121.109 0.48 . . . . 0.0 112.191 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.863 HD22 HD22 ' A' ' 37' ' ' LEU . 9.3 tp -102.55 126.12 49.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.085 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.418 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.0 m -116.0 125.29 52.3 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.218 -0.289 . . . . 0.0 110.218 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.6 t -152.02 153.59 34.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.612 0.244 . . . . 0.0 111.353 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 22.1 m -95.05 126.44 40.39 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 76.6 m -126.02 145.06 50.47 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -74.5 136.58 42.21 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.848 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -93.2 144.37 25.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.691 0.282 . . . . 0.0 111.119 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.3 m -52.02 -28.83 18.49 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.635 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -82.61 1.7 36.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.638 0.256 . . . . 0.0 111.479 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.07 136.15 7.19 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.707 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.5 -170.91 13.47 Favored Glycine 0 C--N 1.319 -0.392 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 -178.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -129.54 143.12 50.69 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 117.286 0.543 . . . . 0.0 111.059 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -153.81 130.13 10.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.174 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.9 t -92.7 134.89 34.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.636 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 26.4 p -122.21 157.79 30.83 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.197 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.1 p -123.69 145.09 49.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.861 0.362 . . . . 0.0 111.086 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.72 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.3 tt -146.34 142.79 21.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.762 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -96.77 118.31 32.94 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.131 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.628 HD22 HD11 ' A' ' 41' ' ' ILE . 9.5 mt -97.4 -6.82 33.18 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.779 ' OD1' HG22 ' A' ' 5' ' ' ILE . 47.9 t30 -45.06 -28.7 0.74 Allowed 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -178.332 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.9 m -80.59 -40.67 25.34 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.685 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.7 m -72.8 -50.82 30.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 113.067 0.765 . . . . 0.0 113.067 -178.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.594 HD12 ' HB3' ' A' ' 87' ' ' LEU . 2.6 mp -82.93 147.35 5.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.137 0.494 . . . . 0.0 111.461 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 4.9 tt0 -138.96 166.83 23.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.96 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -108.02 99.91 9.3 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.059 0.457 . . . . 0.0 110.743 -179.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.43 HG21 ' HG3' ' A' ' 99' ' ' LYS . 48.2 t -99.17 96.88 5.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.848 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.59 ' O ' HG22 ' A' ' 25' ' ' THR . 30.0 t0 52.6 33.67 14.1 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.37 28.35 11.72 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.579 -0.82 . . . . 0.0 113.3 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -140.99 134.11 29.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.907 0.384 . . . . 0.0 111.2 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.414 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 59.3 mt -73.5 119.56 17.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.529 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.43 ' HG3' HG21 ' A' ' 94' ' ' VAL . 2.3 mmmt -125.18 141.75 51.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.194 0.521 . . . . 0.0 111.985 -179.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.451 ' CD2' ' CE1' ' A' ' 40' ' ' HIS . 46.1 t80 -78.36 -32.06 48.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.659 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.94 179.969 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.52 -0.232 . . . . 0.0 112.52 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 52.1 tp -139.34 97.89 3.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.745 0.307 . . . . 0.0 110.986 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 61.65 -105.74 0.99 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.532 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 51.7 mttt 62.99 70.01 0.56 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.928 0.394 . . . . 0.0 111.121 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.464 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 31.0 p90 -92.66 -38.97 11.56 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.127 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.804 HG22 ' OD1' ' A' ' 88' ' ' ASN . 6.8 tp -63.87 -17.63 20.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.736 0.303 . . . . 0.0 111.161 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.62 -26.47 54.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.959 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.0 p -118.67 18.59 13.4 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.183 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.3 m -134.41 154.91 51.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.968 0.413 . . . . 0.0 111.063 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.412 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 1.6 ptm180 -134.25 172.8 12.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.19 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.412 ' OD1' ' O ' ' A' ' 9' ' ' ARG . 6.3 p-10 49.04 57.4 6.5 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.3 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.614 HG21 ' CD1' ' A' ' 5' ' ' ILE . 4.2 p -79.58 134.14 36.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.88 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.758 ' O ' HD12 ' A' ' 19' ' ' LEU . 3.1 pt20 -158.35 163.66 37.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.388 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.761 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.31 135.85 38.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.156 0.503 . . . . 0.0 110.73 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.28 146.12 46.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.085 179.135 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.78 -153.33 25.31 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.814 -1.184 . . . . 0.0 111.408 -179.021 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.0 -36.85 19.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -141.04 36.23 1.74 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.9 OUTLIER -116.05 146.09 42.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.168 0.509 . . . . 0.0 111.881 179.172 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.758 HD12 ' O ' ' A' ' 12' ' ' GLN . 15.2 tp -120.89 125.07 46.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.175 178.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.6 143.93 47.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.858 0.361 . . . . 0.0 110.031 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.28 172.51 16.51 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.386 -178.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.15 133.54 54.23 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.2 m -130.77 132.82 45.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.158 0.504 . . . . 0.0 112.043 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.1 ptpt -66.52 135.73 54.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.105 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.0 p -85.89 -176.28 5.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.633 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.1 mtt-85 -61.46 -29.91 70.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.742 0.306 . . . . 0.0 111.257 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.76 8.86 9.0 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 66.53 37.06 4.69 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.169 0.509 . . . . 0.0 111.059 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.425 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.0 OUTLIER -118.24 136.33 53.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.995 178.103 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -92.64 125.47 37.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.921 0.391 . . . . 0.0 111.858 -178.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.1 m -129.87 152.56 37.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.828 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.4 t -72.75 133.54 44.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.178 0.513 . . . . 0.0 111.592 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -142.11 161.37 38.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.272 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -142.5 154.99 45.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.407 0.622 . . . . 0.0 112.206 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.573 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -136.41 124.87 36.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.821 179.18 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -88.64 120.29 29.9 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.683 0.278 . . . . 0.0 111.036 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.849 HD22 HD22 ' A' ' 69' ' ' LEU . 4.5 mp -88.05 -14.52 38.73 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.5 p-10 -57.49 -45.06 85.34 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -178.151 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.8 OUTLIER -92.3 -10.53 38.03 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 122.106 -0.371 . . . . 0.0 111.569 179.434 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -98.12 -65.56 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.604 HG13 HD23 ' A' ' 37' ' ' LEU . 15.7 mm -80.48 150.16 4.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.708 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.504 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.18 172.29 12.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.726 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.474 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 24.9 t30 -112.71 110.57 20.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.373 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.8 mm -110.86 89.62 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.042 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.4 t70 68.71 39.19 2.04 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.908 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.75 0.66 90.29 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.978 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.1 m -110.53 136.74 49.19 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.933 0.397 . . . . 0.0 110.858 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.9 mt -77.08 116.31 17.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.544 0.687 . . . . 0.0 111.012 -178.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 31.4 mttt -135.25 161.92 34.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.015 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.732 ' CE2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -86.58 119.15 26.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.938 0.399 . . . . 0.0 111.19 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.504 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 1.3 tp-100 -175.51 141.56 0.64 Allowed Pre-proline 0 C--N 1.331 -0.208 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.201 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.47 76.17 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.265 1.977 . . . . 0.0 112.781 -179.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -166.89 135.41 2.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.665 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.08 108.99 15.99 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.416 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 25.4 p90 -49.51 -31.0 9.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.761 178.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.1 p -48.9 -16.77 0.14 Allowed 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -179.122 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -63.27 -29.53 70.84 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.15 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.474 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -128.89 1.86 5.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.286 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.7 m -112.79 147.93 35.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.244 0.545 . . . . 0.0 111.864 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 26.6 p90 -143.21 157.74 44.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.929 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 63.32 44.24 5.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.006 0.432 . . . . 0.0 110.485 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.761 ' O ' HD22 ' A' ' 13' ' ' LEU . 20.5 m -69.08 137.14 53.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.466 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.405 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.87 152.89 42.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.596 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.488 ' CD1' HD13 ' A' ' 19' ' ' LEU . 33.8 mt -129.72 140.44 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-O 121.288 0.566 . . . . 0.0 111.805 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -136.19 108.55 7.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.791 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.411 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.93 -120.84 12.97 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.431 -0.89 . . . . 0.0 111.243 -178.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.402 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.9 p -101.72 -3.67 27.78 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -179.329 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.1 t -101.88 139.23 23.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.977 0.418 . . . . 0.0 111.756 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.849 HD22 HD22 ' A' ' 37' ' ' LEU . 10.6 tp -100.93 125.12 47.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.332 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.6 m -115.6 123.49 48.56 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.2 t -151.92 153.83 34.91 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.41 -178.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 6.3 m -94.18 125.78 39.02 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 88.0 m -126.01 143.95 50.9 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -74.13 136.84 42.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.753 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.414 ' HB3' ' NH1' ' A' ' 75' ' ' ARG . 12.5 mtp-105 -92.15 144.21 25.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.724 0.297 . . . . 0.0 110.503 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.2 m -52.06 -27.12 12.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.749 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -83.56 2.39 37.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.617 0.246 . . . . 0.0 111.651 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.73 136.26 7.07 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.687 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.62 -169.6 12.99 Favored Glycine 0 C--N 1.318 -0.434 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 -178.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -130.0 142.05 50.67 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.266 0.533 . . . . 0.0 111.123 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -153.79 128.74 9.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.203 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.7 t -93.12 134.69 35.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.607 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.3 p -122.9 158.35 30.56 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.443 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 14.9 m -122.71 145.64 48.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.902 0.382 . . . . 0.0 111.201 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.717 HD11 ' CH2' ' A' ' 50' ' ' TRP . 9.9 tt -145.33 143.72 21.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.812 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -97.1 116.29 29.04 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.745 179.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.548 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 11.2 mt -97.62 -4.54 37.32 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.804 ' OD1' HG22 ' A' ' 5' ' ' ILE . 53.5 t30 -44.92 -27.72 0.57 Allowed 'General case' 0 N--CA 1.466 0.342 0 O-C-N 122.155 -0.341 . . . . 0.0 111.874 -178.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.5 -41.28 21.95 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.732 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.5 m -72.67 -52.33 23.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.118 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.653 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -83.13 147.37 5.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.103 0.477 . . . . 0.0 111.279 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 16.9 tt0 -139.92 167.09 22.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.14 -178.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -107.37 99.9 9.38 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.101 0.477 . . . . 0.0 110.805 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 58.8 t -98.53 97.48 6.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.007 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.7 t0 53.07 33.74 15.65 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.27 28.31 11.9 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.662 -0.78 . . . . 0.0 113.111 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.7 m -141.58 135.7 30.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.871 0.367 . . . . 0.0 111.279 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.482 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 63.0 mt -74.24 120.48 19.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.801 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.445 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 14.7 mttt -123.87 137.46 54.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.36 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.429 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 34.9 t80 -82.25 -28.38 31.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.791 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.287 -0.864 . . . . 0.0 110.903 179.871 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -1' ' ' GLY . . . . . 0.406 ' O ' ' N ' ' A' ' 2' ' ' GLY . . . . . . . . 0 N--CA 1.489 2.204 0 N-CA-C 112.597 -0.201 . . . . 0.0 112.597 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 48.5 mt 62.56 -78.37 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.821 0.343 . . . . 0.0 110.934 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' -1' ' ' GLY . . . -141.06 -86.28 0.1 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.408 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 29.1 mttt 63.3 71.15 0.51 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.96 0.41 . . . . 0.0 110.748 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.2 p90 -92.15 -37.0 12.99 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.348 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.799 HG22 ' OD1' ' A' ' 88' ' ' ASN . 5.8 tp -67.7 -11.74 14.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.365 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -76.74 -26.08 54.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.834 0.35 . . . . 0.0 110.552 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.0 p -118.37 -3.35 10.97 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.447 179.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 70.6 m -108.11 150.6 26.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.126 0.488 . . . . 0.0 111.402 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.401 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.4 ptm180 -131.87 172.47 12.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.506 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.406 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.8 p-10 49.45 56.97 7.02 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.062 0.458 . . . . 0.0 111.685 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.707 HG21 ' CD1' ' A' ' 5' ' ' ILE . 8.3 p -79.32 132.59 36.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.691 178.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.726 ' O ' HD12 ' A' ' 19' ' ' LEU . 2.6 pt20 -158.14 163.89 37.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.44 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.72 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.31 136.38 37.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.028 -179.624 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.81 143.59 47.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.163 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.07 -152.27 33.03 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 119.78 -1.2 . . . . 0.0 111.324 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.23 -36.74 19.23 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.1 p -140.9 34.96 1.76 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -178.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -115.22 148.8 38.66 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.073 0.463 . . . . 0.0 111.662 178.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.766 ' CB ' HD11 ' A' ' 37' ' ' LEU . 12.6 tp -122.97 124.9 44.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.346 179.231 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.06 144.15 46.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.3 172.48 16.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.117 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -116.51 133.38 56.09 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 177.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.416 ' SG ' HD21 ' A' ' 98' ' ' LEU . 17.2 m -130.73 136.77 49.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.027 0.441 . . . . 0.0 111.893 -178.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.3 ptpt -66.74 137.9 56.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.481 -179.449 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.465 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.2 p -86.44 -175.78 5.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.879 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -61.64 -31.41 71.51 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 111.523 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.63 9.61 9.14 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 66.84 39.7 3.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.274 0.559 . . . . 0.0 111.381 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.43 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 74.8 mt-30 -118.82 136.65 53.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.664 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -93.77 124.82 38.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.898 0.38 . . . . 0.0 111.641 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.7 m -131.5 148.92 32.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.584 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 73.3 m -71.5 138.57 49.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.328 0.585 . . . . 0.0 112.044 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.6 t -143.94 161.25 39.19 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.18 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmmm? -139.87 154.61 47.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.396 0.617 . . . . 0.0 112.42 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.446 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.3 tp -137.78 125.08 29.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.048 -0.978 . . . . 0.0 108.925 179.037 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -88.97 120.61 30.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.728 0.299 . . . . 0.0 111.071 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.97 HD22 HD22 ' A' ' 69' ' ' LEU . 4.6 mp -88.98 -15.75 33.41 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.982 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.3 p-10 -57.82 -43.06 85.48 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -178.407 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.424 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 7.9 p-10 -92.77 -11.34 34.06 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 122.135 -0.353 . . . . 0.0 111.493 179.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.625 ' CD2' ' CD2' ' A' ' 100' ' ' TYR . 7.1 m80 -97.61 -65.95 0.93 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.616 HD12 ' N ' ' A' ' 41' ' ' ILE . 2.1 mp -80.77 148.78 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.172 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.3 170.84 14.96 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.116 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.538 ' C ' HD12 ' A' ' 44' ' ' ILE . 19.4 t30 -113.03 113.23 25.17 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.926 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.743 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.4 mp -113.16 89.44 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.028 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 69.62 36.83 2.05 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.006 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.81 1.31 85.25 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.695 -0.764 . . . . 0.0 113.467 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 18.1 m -111.69 135.81 51.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 117.252 0.526 . . . . 0.0 111.255 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.3 mt -77.59 116.92 18.54 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.648 0.737 . . . . 0.0 111.599 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.743 ' HB2' HD13 ' A' ' 44' ' ' ILE . 9.8 mttm -137.82 162.74 33.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.921 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.881 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 11.6 m-90 -87.02 121.8 29.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.882 0.372 . . . . 0.0 111.184 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.42 ' O ' ' N ' ' A' ' 53' ' ' SER . 35.2 tt0 -175.6 144.75 0.77 Allowed Pre-proline 0 N--CA 1.464 0.231 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.984 -179.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.424 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 29.9 Cg_endo -64.45 71.56 0.21 Allowed 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.084 1.856 . . . . 0.0 112.785 -179.103 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 51' ' ' GLN . 4.0 p -162.86 133.31 4.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.527 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -81.07 110.18 16.35 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -177.869 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.424 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 37.8 p90 -48.83 -29.38 4.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.402 178.257 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 74.8 p -48.65 -19.08 0.31 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.843 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -61.58 -30.49 70.71 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.34 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.426 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -127.96 -0.19 5.94 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.146 -0.222 . . . . 0.0 111.496 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -110.95 149.19 31.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.247 0.546 . . . . 0.0 112.292 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -143.02 157.43 44.55 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.102 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 64.03 46.52 3.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.003 0.43 . . . . 0.0 110.536 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.72 ' O ' HD22 ' A' ' 13' ' ' LEU . 26.9 m -69.51 136.7 51.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.71 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.451 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.27 151.56 42.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.686 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.53 HG21 HD13 ' A' ' 19' ' ' LEU . 37.5 mt -130.6 139.04 52.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.354 0.597 . . . . 0.0 111.738 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -136.44 111.08 8.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.21 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.49 -121.26 17.14 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.161 -1.019 . . . . 0.0 110.934 -178.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.452 ' HB3' HG21 ' A' ' 5' ' ' ILE . 23.0 p -101.07 -3.88 28.44 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.515 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.7 t -101.67 138.43 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.97 HD22 HD22 ' A' ' 37' ' ' LEU . 7.9 tp -102.56 123.78 46.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.127 179.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.426 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.3 m -114.48 125.86 54.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 t -151.57 153.83 35.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.774 0.321 . . . . 0.0 111.494 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 8.5 m -93.91 126.18 38.96 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 82.7 m -126.03 142.74 51.39 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -75.58 140.1 42.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.799 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -92.82 143.51 26.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.686 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 37.3 m -51.94 -29.78 21.78 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.753 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.47 3.02 29.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.578 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.79 134.68 6.9 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.793 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 118.27 -174.77 15.43 Favored Glycine 0 C--N 1.318 -0.448 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -178.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -129.34 141.74 51.0 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 117.356 0.578 . . . . 0.0 110.845 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -153.95 130.31 10.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.424 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.1 t -92.51 134.49 34.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.48 -179.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.8 p -121.42 157.88 29.56 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.901 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -123.14 146.2 47.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.866 0.365 . . . . 0.0 111.301 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.881 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.7 tt -146.43 143.3 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.869 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -95.98 117.02 29.82 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.848 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.686 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 10.1 mt -96.1 -5.19 41.39 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -178.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.799 ' OD1' HG22 ' A' ' 5' ' ' ILE . 54.3 t30 -44.73 -27.63 0.52 Allowed 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.1 m -81.1 -39.67 25.31 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.74 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -73.49 -53.43 18.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -177.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.606 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.89 147.13 6.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.175 0.512 . . . . 0.0 112.042 -178.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.45 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 12.5 tt0 -138.96 166.17 25.18 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.923 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -107.58 99.75 9.22 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.193 0.52 . . . . 0.0 110.767 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.481 HG11 ' HE3' ' A' ' 99' ' ' LYS . 40.6 t -97.93 96.98 5.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.745 179.136 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.465 ' O ' HG22 ' A' ' 25' ' ' THR . 22.3 t0 54.07 33.11 16.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.704 0.288 . . . . 0.0 111.56 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.56 28.45 12.67 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 120.723 -0.751 . . . . 0.0 113.223 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 68.0 p -140.33 135.94 32.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.898 0.38 . . . . 0.0 111.219 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.45 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 31.2 mt -74.21 119.35 18.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.067 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.481 ' HE3' HG11 ' A' ' 94' ' ' VAL . 7.1 mttt -124.29 138.25 54.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.447 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.625 ' CD2' ' CD2' ' A' ' 40' ' ' HIS . 32.5 t80 -79.23 150.21 31.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.01 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.405 ' N ' ' O ' ' A' ' 90' ' ' VAL . 11.7 tt0 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.191 -0.909 . . . . 0.0 111.081 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 112.537 -0.225 . . . . 0.0 112.537 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 10.1 tp -96.45 159.08 15.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.863 0.363 . . . . 0.0 110.978 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -65.32 -85.7 0.07 OUTLIER Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.744 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.3 mttt 65.58 72.73 0.41 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.763 0.316 . . . . 0.0 110.909 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.437 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 19.7 p90 -95.8 -38.0 10.5 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.444 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.805 HG22 ' OD1' ' A' ' 88' ' ' ASN . 3.8 tp -65.5 -14.43 16.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.707 0.289 . . . . 0.0 111.129 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 mp0 -76.33 -27.23 56.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.786 0.327 . . . . 0.0 110.528 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.3 p -119.23 19.1 12.92 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.181 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.9 m -131.35 154.86 48.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.136 0.494 . . . . 0.0 111.771 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -134.93 173.07 12.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.065 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 p30 49.32 57.12 6.83 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.706 HG21 ' CD1' ' A' ' 5' ' ' ILE . 4.9 p -79.54 130.55 35.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.63 178.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.634 ' O ' HD12 ' A' ' 19' ' ' LEU . 3.4 pt20 -156.43 163.26 39.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.64 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.682 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.98 136.6 38.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.187 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.88 143.17 48.08 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.462 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.3 -150.1 37.93 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.025 -1.083 . . . . 0.0 111.82 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.69 -37.1 18.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -143.23 35.64 1.35 Allowed 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -114.43 146.57 40.45 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.815 0.34 . . . . 0.0 111.484 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.775 ' HB3' HD11 ' A' ' 37' ' ' LEU . 9.9 tp -120.29 123.21 42.6 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.285 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.18 144.63 47.6 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.56 172.55 16.17 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.876 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -112.3 134.31 53.91 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 177.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.0 m -130.46 134.83 47.4 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.39 -0.524 . . . . 0.0 112.228 -178.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 6.3 ptpt -67.3 135.51 53.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.326 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.585 HG22 ' O ' ' A' ' 95' ' ' ASP . 64.1 p -85.16 -179.33 6.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.27 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 45.8 mtt-85 -59.3 -29.69 67.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.559 -179.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.79 10.68 8.94 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 66.9 39.27 3.39 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.025 0.441 . . . . 0.0 112.005 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -121.44 132.63 54.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.026 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.445 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 46.8 m-85 -90.65 126.46 35.98 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.108 0.48 . . . . 0.0 111.922 -178.517 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.1 m -131.06 151.61 36.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.793 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 41.5 m -71.06 134.6 47.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.228 0.537 . . . . 0.0 111.948 -178.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.3 t -142.11 161.82 37.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.284 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.11 156.02 45.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.321 0.582 . . . . 0.0 112.394 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.455 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -138.46 125.0 25.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.113 -0.949 . . . . 0.0 108.774 179.25 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -87.17 115.92 24.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.649 0.261 . . . . 0.0 111.199 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.865 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -87.17 -16.29 35.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.391 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.86 -45.84 74.62 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.64 0.257 . . . . 0.0 111.467 -178.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.47 -10.4 37.96 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.401 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 28.6 m-70 -97.86 -65.9 0.93 Allowed 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.62 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.9 mp -80.03 149.29 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.295 178.755 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.36 172.68 12.35 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.933 -179.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.529 ' C ' HD12 ' A' ' 44' ' ' ILE . 20.0 t30 -112.72 112.27 23.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.219 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.808 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.1 mp -111.85 93.46 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-O 120.865 0.364 . . . . 0.0 110.805 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 38.3 t0 64.78 39.64 6.07 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.206 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.28 1.83 90.38 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.562 -0.828 . . . . 0.0 113.123 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 20.9 m -112.46 137.13 51.11 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 117.187 0.494 . . . . 0.0 111.004 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 66.3 mt -77.72 118.55 20.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.433 0.635 . . . . 0.0 112.326 -177.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.808 ' HB2' HD13 ' A' ' 44' ' ' ILE . 37.5 mttt -139.65 163.34 32.84 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.101 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.743 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.8 m-90 -87.1 121.71 29.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 111.637 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.447 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 38.5 tt0 -175.26 145.3 0.85 Allowed Pre-proline 0 N--CA 1.466 0.332 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.909 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.447 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 37.1 Cg_endo -65.25 71.26 0.28 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.267 1.978 . . . . 0.0 112.797 -179.06 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.405 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -162.48 133.19 4.84 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.47 179.064 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.16 112.4 18.47 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.247 0.546 . . . . 0.0 112.457 -177.634 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.473 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 49.3 p90 -51.56 -30.39 20.56 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.952 178.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.7 p -50.87 -17.36 0.55 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -62.07 -29.46 70.32 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.042 -0.263 . . . . 0.0 110.634 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.438 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -129.04 0.66 5.25 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.664 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.5 m -112.16 147.96 35.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.112 0.482 . . . . 0.0 112.06 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -141.71 157.39 45.11 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.24 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 63.49 44.89 5.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.105 0.479 . . . . 0.0 110.456 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.682 ' O ' HD22 ' A' ' 13' ' ' LEU . 70.7 m -68.51 137.0 54.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.663 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.62 152.6 41.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.822 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.471 ' CG1' HD13 ' A' ' 69' ' ' LEU . 58.3 mt -130.94 140.74 47.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.337 0.589 . . . . 0.0 111.628 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -137.78 109.48 7.07 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.652 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.89 -122.43 13.49 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.675 -178.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.492 ' HB3' HG21 ' A' ' 5' ' ' ILE . 22.4 p -101.78 -2.8 29.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 117.012 0.406 . . . . 0.0 112.085 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.43 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.5 t -102.54 137.3 31.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-O 120.957 0.408 . . . . 0.0 111.752 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.865 HD22 HD22 ' A' ' 37' ' ' LEU . 7.5 tp -100.89 124.08 46.04 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.349 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.448 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -114.24 125.5 53.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.111 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.7 t -151.58 153.59 34.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.794 0.331 . . . . 0.0 111.722 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.1 m -94.42 126.02 39.43 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.3 m -127.7 145.32 50.94 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -178.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -74.86 138.03 42.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.477 177.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 56.4 mtp180 -91.09 142.98 27.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.555 0.217 . . . . 0.0 110.532 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 62.7 m -52.1 -25.13 8.06 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.694 0.283 . . . . 0.0 111.554 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -84.13 1.57 43.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.387 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.42 135.83 7.21 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.839 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.06 -167.34 12.3 Favored Glycine 0 C--N 1.32 -0.335 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -131.99 141.49 49.29 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 117.329 0.564 . . . . 0.0 111.594 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -153.99 129.89 10.19 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.454 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.6 t -92.13 135.18 34.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.737 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.2 p -121.88 158.33 29.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.203 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 4.5 p -121.87 145.65 47.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.797 0.332 . . . . 0.0 111.104 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.712 HD11 ' CH2' ' A' ' 50' ' ' TRP . 13.2 tt -144.42 143.32 23.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.647 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -97.15 117.6 31.7 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.781 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.625 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 6.8 mt -99.4 -4.61 31.16 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -178.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.805 ' OD1' HG22 ' A' ' 5' ' ' ILE . 54.2 t30 -44.82 -29.1 0.73 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -178.358 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.7 m -81.32 -41.67 21.73 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.743 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -70.58 -52.76 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -177.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.581 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.8 mp -83.33 147.59 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.913 0.387 . . . . 0.0 111.543 -179.296 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.419 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 31.3 tt0 -138.51 165.57 26.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.22 -179.033 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -105.96 99.53 9.11 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 121.183 0.516 . . . . 0.0 110.766 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 47.8 t -97.54 97.12 5.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.538 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.585 ' O ' HG22 ' A' ' 25' ' ' THR . 26.0 t0 53.19 33.29 14.95 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.763 0.282 . . . . 0.0 111.763 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.5 28.63 11.13 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.752 -0.737 . . . . 0.0 113.253 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.28 135.24 30.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.931 0.396 . . . . 0.0 110.971 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 79.2 mt -74.01 119.86 18.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.803 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -123.02 131.03 53.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.417 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.423 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 14.2 t80 -84.06 -45.8 12.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.147 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.289 -0.862 . . . . 0.0 111.103 -179.986 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.203 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -158.43 128.37 5.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.669 0.271 . . . . 0.0 110.838 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 154.73 148.58 5.02 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.617 -0.802 . . . . 0.0 112.736 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.3 ptpt -152.15 86.22 1.29 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.766 0.317 . . . . 0.0 111.171 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.425 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 13.6 p90 -93.11 -40.61 10.41 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.296 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.736 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.0 tp -63.04 -20.04 24.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.449 -179.518 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -77.64 -25.51 49.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.784 0.326 . . . . 0.0 110.552 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.0 p -118.4 16.66 13.87 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.849 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.3 m -134.13 155.7 49.61 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.99 0.424 . . . . 0.0 111.37 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.41 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.9 ptt180 -132.29 172.9 11.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.945 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.438 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.2 p-10 49.52 57.46 6.48 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.239 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.614 HG21 ' CD1' ' A' ' 5' ' ' ILE . 19.3 p -78.94 132.15 36.62 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.659 ' O ' HD12 ' A' ' 19' ' ' LEU . 8.3 pt20 -157.66 163.85 37.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.616 -179.279 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.676 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.21 136.52 37.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.037 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.9 143.63 47.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.134 179.039 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.15 -152.19 33.51 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 119.849 -1.167 . . . . 0.0 111.534 -178.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.47 -37.01 18.71 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -178.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.1 p -141.25 35.65 1.7 Allowed 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.0 OUTLIER -115.69 146.74 41.59 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.156 0.503 . . . . 0.0 111.833 178.873 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.823 ' CB ' HD11 ' A' ' 37' ' ' LEU . 13.3 tp -119.09 124.13 46.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.321 179.023 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.85 143.19 47.12 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.09 172.24 17.15 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.33 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -112.17 133.65 54.18 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 83.7 m -130.97 134.56 46.84 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.2 ptpt -67.03 136.02 54.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.241 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.498 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.8 p -85.77 -177.81 6.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.272 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.8 mmp_? -61.26 -29.32 69.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.87 0.366 . . . . 0.0 110.794 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.44 8.72 8.71 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 66.56 36.35 4.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.262 0.553 . . . . 0.0 111.037 -178.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.419 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 25.2 mt-30 -118.53 136.93 53.55 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.862 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -93.06 124.76 37.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.909 0.385 . . . . 0.0 111.702 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.44 HG22 HG23 ' A' ' 25' ' ' THR . 4.2 m -129.98 149.72 33.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.619 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.2 p -71.02 135.06 47.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.185 0.517 . . . . 0.0 111.88 -178.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.9 t -142.51 161.42 38.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.253 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -142.35 156.72 45.26 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.394 0.616 . . . . 0.0 112.371 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.582 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -139.52 125.18 21.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.087 179.335 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -87.66 120.35 28.89 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.663 0.268 . . . . 0.0 111.289 -178.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.823 HD11 ' CB ' ' A' ' 19' ' ' LEU . 4.2 mp -88.35 -15.29 36.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.825 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.428 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.6 p-10 -57.51 -43.36 84.19 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 5.1 p30 -92.48 -10.58 37.31 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 122.077 -0.389 . . . . 0.0 111.848 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -99.51 -63.33 1.13 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.62 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.5 mp -79.64 147.16 6.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.791 178.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.42 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.41 170.05 16.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.654 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.53 ' C ' HD12 ' A' ' 44' ' ' ILE . 27.1 t30 -113.21 111.79 22.66 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.292 -179.267 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.792 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.3 mp -112.37 89.56 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.529 179.137 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.3 t70 68.52 38.81 2.27 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.042 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.95 0.83 90.52 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.624 -0.798 . . . . 0.0 113.426 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.8 m -108.72 135.33 50.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 117.334 0.567 . . . . 0.0 110.507 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.456 HD22 HG21 ' A' ' 41' ' ' ILE . 20.0 mt -77.49 117.0 18.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.65 0.738 . . . . 0.0 111.693 -177.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.792 ' HB2' HD13 ' A' ' 44' ' ' ILE . 10.3 mttm -138.3 163.26 32.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.577 179.687 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.702 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.1 m-90 -88.03 122.4 31.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.856 0.36 . . . . 0.0 111.791 -179.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.455 ' CG ' ' O ' ' A' ' 50' ' ' TRP . 26.4 mt-30 -171.16 149.81 2.73 Favored Pre-proline 0 N--CA 1.47 0.53 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.65 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -69.74 66.48 1.76 Allowed 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 121.831 1.687 . . . . 0.0 112.035 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.7 134.57 9.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.967 -1.015 . . . . 0.0 108.732 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -81.54 109.88 16.41 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -178.184 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.437 ' CD1' HG22 ' A' ' 41' ' ' ILE . 38.4 p90 -48.45 -29.73 4.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.576 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.2 p -48.36 -19.36 0.3 Allowed 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -62.46 -24.82 67.65 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.499 -178.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.446 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -133.3 2.4 3.55 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.4 m -112.58 148.53 34.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.13 0.49 . . . . 0.0 112.318 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -139.97 155.51 47.09 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.942 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 64.19 49.63 2.59 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.953 0.406 . . . . 0.0 111.103 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.676 ' O ' HD22 ' A' ' 13' ' ' LEU . 44.9 m -71.34 135.2 47.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.788 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.505 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.85 151.93 41.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.507 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.462 ' CG1' HD13 ' A' ' 69' ' ' LEU . 38.1 mt -129.94 140.49 48.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.27 0.557 . . . . 0.0 111.848 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -136.6 110.63 8.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.507 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.32 -121.87 16.71 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.224 -0.989 . . . . 0.0 110.887 -178.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.424 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.6 p -101.54 -3.21 28.9 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.581 HG13 ' O ' ' A' ' 85' ' ' ILE . 9.0 t -102.86 140.7 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 120.985 0.421 . . . . 0.0 111.814 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.807 HD22 HD22 ' A' ' 37' ' ' LEU . 9.2 tp -102.85 126.79 50.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.498 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.418 ' N ' HD12 ' A' ' 69' ' ' LEU . 5.6 m -115.21 124.23 50.87 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 t -151.78 153.64 34.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.742 0.306 . . . . 0.0 111.288 -178.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.8 m -94.42 125.7 39.23 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 75.2 m -126.16 143.41 51.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.435 0.636 . . . . 0.0 112.514 -178.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -75.7 139.53 41.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.89 178.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 47.8 mtp85 -93.55 144.63 25.19 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.754 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.6 m -51.85 -28.39 15.76 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.786 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -83.15 1.98 37.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.497 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.2 136.69 7.48 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.778 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.7 -170.78 13.51 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -131.22 141.85 50.09 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.238 0.519 . . . . 0.0 111.121 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 41.0 t30 -154.14 129.49 9.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.347 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.2 t -92.72 134.78 34.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.714 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.4 p -121.83 158.48 28.82 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.546 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 46.0 m -121.9 143.96 49.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.359 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.699 HD11 ' CH2' ' A' ' 50' ' ' TRP . 12.6 tt -145.11 143.08 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.843 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -96.97 116.26 28.88 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.035 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.61 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 9.8 mt -97.44 -6.83 33.04 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.736 ' OD1' HG22 ' A' ' 5' ' ' ILE . 37.6 t30 -45.1 -27.53 0.6 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -178.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 61.7 m -81.88 -41.15 21.37 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.702 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.9 m -71.65 -51.18 34.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -178.056 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.618 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.8 mp -82.8 147.51 5.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.965 0.412 . . . . 0.0 111.182 -179.172 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -138.38 166.58 23.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.04 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -107.64 99.77 9.23 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.074 0.464 . . . . 0.0 110.629 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.5 t -98.36 97.11 5.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.868 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.498 ' O ' HG22 ' A' ' 25' ' ' THR . 34.2 t0 52.83 33.2 13.75 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.24 28.72 11.2 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.581 -0.819 . . . . 0.0 113.371 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 54.1 p -141.1 134.96 30.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.925 0.393 . . . . 0.0 111.289 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.427 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 41.1 mt -73.31 119.16 17.16 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.681 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.3 mttm -125.21 139.32 53.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.639 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -80.64 -53.78 6.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.59 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.211 -0.9 . . . . 0.0 110.769 179.746 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.446 -0.261 . . . . 0.0 112.446 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.0 tt -109.12 -61.6 1.6 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.817 0.342 . . . . 0.0 110.972 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -71.83 148.68 43.55 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.873 -0.679 . . . . 0.0 112.843 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.2 mtmt -150.62 82.73 1.35 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.865 0.364 . . . . 0.0 110.442 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.456 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 15.6 p90 -91.16 -40.4 11.59 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.855 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.76 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.0 tp -61.77 -20.76 24.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.663 0.268 . . . . 0.0 111.618 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -75.92 -23.92 55.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.198 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.0 p -118.17 8.43 12.36 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 m -125.39 154.86 41.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.077 0.465 . . . . 0.0 111.226 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.2 173.18 11.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.814 -179.766 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.416 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.8 p-10 49.18 58.13 5.72 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.005 0.431 . . . . 0.0 112.152 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.609 HG21 ' CD1' ' A' ' 5' ' ' ILE . 9.9 p -79.57 131.98 36.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.784 178.43 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.742 ' O ' HD12 ' A' ' 19' ' ' LEU . 11.5 pt20 -157.45 163.72 38.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.448 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.745 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.37 136.72 37.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.841 -179.65 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.85 143.9 47.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.435 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.35 -151.01 36.49 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 119.927 -1.13 . . . . 0.0 111.522 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.28 -37.2 18.8 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.463 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.18 35.86 1.53 Allowed 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -114.36 149.99 35.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.02 0.438 . . . . 0.0 111.806 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.767 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.3 tp -123.56 124.22 42.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.546 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.42 144.31 47.01 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.865 0.364 . . . . 0.0 110.196 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.38 172.24 16.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.373 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -111.52 134.12 53.31 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 64.2 m -131.01 132.32 44.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.141 0.496 . . . . 0.0 112.103 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.433 ' HB3' ' CE2' ' A' ' 30' ' ' PHE . 1.9 ptpt -66.41 136.93 56.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.219 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.474 HG22 ' O ' ' A' ' 95' ' ' ASP . 82.6 p -85.86 -178.47 6.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.481 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 29.9 mtt180 -60.82 -30.06 69.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.766 0.317 . . . . 0.0 111.03 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.78 9.06 8.6 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 66.96 37.32 3.93 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.145 0.497 . . . . 0.0 111.635 -178.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 47.0 mt-30 -118.5 135.46 54.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.009 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.433 ' CE2' ' HB3' ' A' ' 24' ' ' LYS . 77.5 m-85 -92.34 124.61 36.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.994 0.426 . . . . 0.0 111.879 -178.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.6 m -129.88 148.24 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.295 179.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.4 t -70.14 136.49 50.18 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.305 0.574 . . . . 0.0 111.814 -178.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.7 t -143.14 161.53 37.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.994 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.3 ttpt -142.6 157.12 45.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.289 0.566 . . . . 0.0 111.901 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.462 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -138.6 127.13 29.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.29 179.592 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -87.68 117.02 26.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.629 0.252 . . . . 0.0 111.511 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.84 HD22 HD22 ' A' ' 69' ' ' LEU . 4.2 mp -86.11 -16.18 38.8 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.61 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -55.08 -48.03 74.09 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.886 -178.625 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.439 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.6 OUTLIER -92.08 -10.06 40.42 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 122.26 -0.275 . . . . 0.0 111.508 179.536 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.415 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 23.4 m-70 -96.5 -69.54 0.75 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.621 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.8 mp -79.34 151.36 4.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.137 178.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.421 ' HB1' ' OG ' ' A' ' 53' ' ' SER . . . -141.74 172.38 12.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.956 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.58 HD22 ' HA2' ' A' ' 46' ' ' GLY . 27.3 t-20 -112.82 113.1 25.04 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.971 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.887 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.6 mp -113.25 89.95 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.818 0.342 . . . . 0.0 111.327 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 39.6 t0 69.32 38.77 1.78 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.587 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.58 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 84.15 3.37 88.97 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 120.598 -0.81 . . . . 0.0 113.061 179.428 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 52.1 m -115.89 137.4 52.14 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.944 0.402 . . . . 0.0 111.124 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.9 mt -77.45 116.64 18.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.569 0.699 . . . . 0.0 111.925 -177.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.887 ' HB2' HD13 ' A' ' 44' ' ' ILE . 38.3 mttt -137.22 162.56 33.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.701 -1.136 . . . . 0.0 109.527 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.728 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 6.1 m-90 -87.67 124.1 33.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.103 0.478 . . . . 0.0 112.062 -179.063 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.441 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 52.1 tt0 -176.33 149.72 0.97 Allowed Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.179 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.441 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 12.3 Cg_exo -67.94 66.15 0.93 Allowed 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.27 1.98 . . . . 0.0 112.485 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.421 ' OG ' ' HB1' ' A' ' 42' ' ' ALA . 3.1 p -155.92 135.44 12.44 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.726 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.435 ' ND2' ' N ' ' A' ' 54' ' ' ASN . 0.0 OUTLIER -82.62 106.6 14.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.216 0.532 . . . . 0.0 112.313 -177.701 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.463 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 33.8 p90 -47.78 -30.18 3.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.532 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.6 p -49.35 -18.03 0.33 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.893 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -64.78 -26.93 68.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.569 0.223 . . . . 0.0 111.6 -178.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.3 p -128.68 -3.42 5.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.558 0.218 . . . . 0.0 111.485 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.8 m -109.2 148.96 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.207 0.527 . . . . 0.0 111.894 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.4 p90 -142.23 157.35 44.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.946 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.6 m-20 63.21 45.44 5.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.043 0.449 . . . . 0.0 110.75 -179.391 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.745 ' O ' HD22 ' A' ' 13' ' ' LEU . 21.4 m -69.25 137.08 52.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.604 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -141.38 151.17 43.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.489 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.542 HG21 HD13 ' A' ' 19' ' ' LEU . 24.3 mt -129.29 140.27 49.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.297 0.57 . . . . 0.0 111.823 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -136.77 108.92 7.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.238 -0.892 . . . . 0.0 108.98 179.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.75 -120.53 11.13 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.264 -0.97 . . . . 0.0 111.077 -178.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.438 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 20.6 p -103.33 -0.86 29.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.808 0.304 . . . . 0.0 111.514 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.492 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.7 t -103.61 139.11 25.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-O 120.934 0.397 . . . . 0.0 111.709 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.84 HD22 HD22 ' A' ' 37' ' ' LEU . 11.6 tp -103.94 124.9 49.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.345 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.3 m -114.86 125.22 53.41 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -152.13 153.88 34.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.625 0.25 . . . . 0.0 111.438 -178.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.4 m -94.26 125.8 39.11 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.493 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.523 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 96.1 m -123.87 142.38 51.17 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -73.7 137.31 43.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.873 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 18.7 mtm180 -91.45 142.39 27.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.694 0.283 . . . . 0.0 110.322 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.9 m -52.0 -28.99 18.87 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -83.73 3.82 31.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.656 0.265 . . . . 0.0 111.641 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.92 135.65 7.37 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.905 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.35 -171.95 14.0 Favored Glycine 0 C--N 1.319 -0.378 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -178.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -131.28 144.02 50.98 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 117.308 0.554 . . . . 0.0 111.263 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -154.2 129.53 9.77 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.302 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.6 t -92.54 134.88 34.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.74 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 81.3 p -122.35 158.07 30.43 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.317 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.9 m -122.9 144.06 49.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.871 0.367 . . . . 0.0 111.148 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.728 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.5 tt -145.65 143.99 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.895 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -97.58 116.3 29.52 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.798 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.636 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 6.0 mt -98.31 -6.64 30.53 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.76 ' OD1' HG22 ' A' ' 5' ' ' ILE . 37.3 t30 -44.98 -27.98 0.61 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -178.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.0 t -81.93 -39.81 23.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.721 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -72.49 -52.08 25.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.334 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.553 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.53 147.64 5.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.007 0.432 . . . . 0.0 110.86 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 99' ' ' LYS . 10.9 tt0 -139.31 166.71 23.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.207 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -107.5 99.94 9.4 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.101 0.477 . . . . 0.0 110.662 -179.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.491 HG21 ' HG3' ' A' ' 99' ' ' LYS . 61.7 t -100.38 97.96 6.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.04 179.254 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.474 ' O ' HG22 ' A' ' 25' ' ' THR . 25.1 t0 53.53 32.03 13.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.656 0.265 . . . . 0.0 111.672 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.93 28.55 10.85 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.619 -0.801 . . . . 0.0 113.369 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 36.1 t -140.93 134.45 29.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.902 0.382 . . . . 0.0 111.193 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.41 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 42.9 mt -73.01 119.51 17.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.75 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.491 ' HG3' HG21 ' A' ' 94' ' ' VAL . 26.2 mmtt -122.99 132.17 54.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.072 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.415 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 13.2 t80 -80.48 -34.13 36.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.61 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.327 -0.844 . . . . 0.0 111.069 179.76 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.217 0 N-CA-C 112.405 -0.278 . . . . 0.0 112.405 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.469 ' O ' HD12 ' A' ' 1' ' ' LEU . 3.5 pp -88.09 125.28 34.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.837 0.351 . . . . 0.0 110.507 179.62 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 88.45 -125.57 7.74 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.064 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.9 mttt 60.56 51.08 5.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.762 0.315 . . . . 0.0 110.747 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.485 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 18.2 p90 -88.05 -41.06 13.34 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.075 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.831 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.3 tp -62.22 -22.31 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.778 0.323 . . . . 0.0 111.239 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -73.06 -24.43 60.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.832 0.349 . . . . 0.0 110.852 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.7 p -119.19 17.37 13.17 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.871 0.367 . . . . 0.0 111.723 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.9 m -133.21 155.28 49.63 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.0 0.428 . . . . 0.0 110.919 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.0 ptt85 -135.64 172.93 12.3 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.403 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.428 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.1 p-10 48.29 57.93 5.68 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.736 -0.666 . . . . 0.0 112.445 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.719 HG21 ' CD1' ' A' ' 5' ' ' ILE . 22.0 p -78.99 135.55 36.94 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.05 178.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.721 ' O ' HD12 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -158.91 163.52 36.48 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.039 0.447 . . . . 0.0 111.678 -179.407 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.734 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.61 136.5 37.91 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.807 179.897 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.9 143.14 48.11 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.407 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.61 -149.14 33.4 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 119.944 -1.122 . . . . 0.0 111.887 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -87.3 -37.77 16.87 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -177.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.8 p -141.62 36.36 1.64 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -115.93 149.64 38.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.257 0.551 . . . . 0.0 111.976 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.821 ' CB ' HD11 ' A' ' 37' ' ' LEU . 14.0 tp -123.49 123.79 41.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.768 178.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.91 142.68 47.07 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.64 172.78 15.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.523 -178.415 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -113.36 134.12 54.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.404 ' SG ' HD21 ' A' ' 98' ' ' LEU . 83.9 m -131.19 132.84 44.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.924 0.392 . . . . 0.0 111.82 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 5.2 ptpt -64.63 138.9 58.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.228 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.466 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.5 p -86.97 -176.87 5.9 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.506 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -61.02 -30.65 70.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.884 0.373 . . . . 0.0 111.277 -179.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.13 10.48 8.13 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -178.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 67.43 37.72 3.41 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.165 0.507 . . . . 0.0 111.216 -178.572 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -119.06 133.58 55.72 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.363 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.434 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 34.3 m-85 -91.3 125.42 36.06 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.115 0.483 . . . . 0.0 112.101 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.9 m -128.65 151.64 35.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.934 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.5 p -71.29 132.89 45.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.263 0.554 . . . . 0.0 111.784 -178.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.0 t -142.09 162.35 35.71 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.183 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.11 154.7 43.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.378 0.608 . . . . 0.0 111.85 -179.008 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.76 125.78 41.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 179.235 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -88.02 117.49 26.93 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.952 -178.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.821 HD11 ' CB ' ' A' ' 19' ' ' LEU . 3.4 mp -87.87 -15.87 35.53 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.0 p-10 -57.72 -44.86 86.28 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -177.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.434 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 3.5 m-20 -91.86 -9.97 41.42 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 122.047 -0.408 . . . . 0.0 111.247 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.458 ' CD2' ' CD2' ' A' ' 100' ' ' TYR . 3.8 m80 -93.28 -63.55 1.2 Allowed 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.645 ' CD1' HD23 ' A' ' 37' ' ' LEU . 34.9 mt -83.05 154.03 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.965 178.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.59 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -142.0 171.89 13.44 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.257 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.604 ' C ' HD12 ' A' ' 44' ' ' ILE . 25.8 t30 -112.6 111.36 22.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.618 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.813 HD13 ' HB2' ' A' ' 49' ' ' LYS . 1.9 mp -111.7 88.56 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-O 121.05 0.452 . . . . 0.0 110.736 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 52.3 t0 67.91 39.39 2.58 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.16 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.1 2.68 90.56 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.741 -0.743 . . . . 0.0 113.348 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.6 m -109.92 136.38 49.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.199 0.499 . . . . 0.0 111.264 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.425 HD12 ' O ' ' A' ' 83' ' ' SER . 23.6 mt -77.1 116.29 17.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.701 0.762 . . . . 0.0 111.465 -178.072 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.813 ' HB2' HD13 ' A' ' 44' ' ' ILE . 41.3 mttt -139.43 163.52 32.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.684 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.799 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 9.5 m-90 -88.64 127.52 35.57 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.409 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.59 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.6 OUTLIER -174.46 151.96 1.65 Allowed Pre-proline 0 N--CA 1.469 0.519 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.539 -179.772 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.434 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 63.7 Cg_endo -74.12 66.17 5.2 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 121.945 1.763 . . . . 0.0 112.485 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -162.36 133.2 4.94 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.7 -1.136 . . . . 0.0 107.969 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.1 114.22 17.86 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -177.219 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 39.5 p90 -48.95 -29.24 4.56 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.386 177.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.6 p -49.83 -18.89 0.56 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.356 -178.638 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -60.8 -26.53 67.37 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.639 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.407 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.5 p -131.16 1.65 4.23 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.1 m -113.76 147.35 38.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.298 0.57 . . . . 0.0 112.481 -178.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.3 p90 -141.24 157.91 44.61 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.073 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 64.99 45.71 3.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.997 0.427 . . . . 0.0 111.39 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.734 ' O ' HD22 ' A' ' 13' ' ' LEU . 46.4 m -67.82 135.51 52.69 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.639 179.59 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.494 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.56 151.8 41.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.561 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.483 ' CG1' HD13 ' A' ' 69' ' ' LEU . 48.3 mt -130.15 139.75 50.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.315 0.579 . . . . 0.0 111.907 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -134.05 109.09 8.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.932 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 65.59 -119.37 13.77 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.215 -0.993 . . . . 0.0 111.205 -178.564 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 19.4 p -101.53 -5.59 24.97 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.6 t -101.03 138.27 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 120.872 0.368 . . . . 0.0 111.583 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.817 HD22 HD22 ' A' ' 37' ' ' LEU . 7.7 tp -101.12 125.7 47.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.138 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.483 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.0 m -115.07 125.55 53.66 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.8 t -151.4 153.16 34.17 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.331 -178.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.437 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.4 m -93.91 126.0 38.86 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 89.7 m -126.58 144.6 50.84 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -73.36 134.99 44.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.48 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.0 mtp85 -92.09 142.88 27.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.647 0.26 . . . . 0.0 110.654 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 33.1 m -51.54 -28.2 13.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.67 -178.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -82.11 1.87 34.01 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.538 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.81 133.72 6.53 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.997 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.3 -167.48 12.5 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.18 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -130.89 142.15 50.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.797 0.298 . . . . 0.0 111.178 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -154.74 130.79 10.23 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.685 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.437 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -93.82 134.46 36.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.102 0.477 . . . . 0.0 111.574 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.425 ' O ' HD12 ' A' ' 48' ' ' LEU . 24.3 p -120.67 158.93 26.36 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.636 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.3 p -123.92 145.85 48.86 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.859 0.361 . . . . 0.0 111.191 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.799 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.2 tt -144.89 143.33 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.637 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -96.92 116.93 30.05 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.419 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.621 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 6.9 mt -95.83 -4.71 43.28 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -178.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.831 ' OD1' HG22 ' A' ' 5' ' ' ILE . 56.1 t30 -43.76 -29.31 0.51 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.289 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.3 m -81.77 -40.43 22.65 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.697 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.5 m -70.86 -53.17 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.765 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.579 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -83.13 145.29 8.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.281 0.562 . . . . 0.0 112.052 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.409 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 16.1 tt0 -135.75 165.49 25.47 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.942 -178.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -107.18 99.84 9.35 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.971 0.415 . . . . 0.0 111.141 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 25.7 t -99.53 99.34 8.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.798 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.466 ' O ' HG22 ' A' ' 25' ' ' THR . 28.9 t0 53.08 32.09 12.39 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.773 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.15 28.83 10.26 Favored Glycine 0 C--N 1.329 0.144 0 C-N-CA 120.579 -0.82 . . . . 0.0 113.149 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 t -141.01 135.95 31.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.864 0.364 . . . . 0.0 111.029 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.409 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 67.5 mt -74.6 121.3 21.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.0 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -127.24 137.21 52.83 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-O 121.065 0.46 . . . . 0.0 112.202 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.458 ' CD2' ' CD2' ' A' ' 40' ' ' HIS . 35.8 t80 -75.95 -41.97 49.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.686 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.153 -0.927 . . . . 0.0 111.087 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.413 -0.275 . . . . 0.0 112.413 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.426 HD23 ' N ' ' A' ' 2' ' ' GLY . 1.4 tt -105.25 129.92 53.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.804 0.335 . . . . 0.0 110.762 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.426 ' N ' HD23 ' A' ' 1' ' ' LEU . . . 61.53 -105.52 0.92 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.457 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.2 mttt 60.61 66.75 0.89 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.855 0.36 . . . . 0.0 110.899 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.453 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 23.1 p90 -92.75 -38.26 11.9 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.312 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.803 HG22 ' OD1' ' A' ' 88' ' ' ASN . 7.3 tp -65.5 -15.68 19.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.696 0.284 . . . . 0.0 111.334 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -75.4 -25.24 57.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.764 0.316 . . . . 0.0 110.659 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.9 p -118.8 18.19 13.36 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.465 179.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.2 m -133.41 154.76 50.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.947 0.403 . . . . 0.0 111.441 -179.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -133.69 172.74 12.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.174 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 49.0 57.77 6.09 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.209 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.675 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.2 p -79.39 133.11 36.57 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.394 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.647 ' O ' HD12 ' A' ' 19' ' ' LEU . 18.5 pt20 -157.76 163.77 37.75 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.399 -178.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.739 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.35 135.4 39.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.574 179.748 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -118.9 143.54 46.94 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.195 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.69 -151.49 33.06 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 119.891 -1.147 . . . . 0.0 111.465 -178.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.64 -37.19 18.27 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.087 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.8 35.24 1.78 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.6 mp0 -115.91 146.96 41.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.017 0.437 . . . . 0.0 111.775 179.173 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.794 ' CB ' HD11 ' A' ' 37' ' ' LEU . 10.2 tp -119.75 124.91 47.35 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 178.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.89 143.58 47.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.922 0.392 . . . . 0.0 110.486 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.35 172.46 16.53 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.164 -178.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.33 133.88 54.18 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 177.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.6 m -130.54 133.16 46.01 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.255 0.55 . . . . 0.0 111.935 -178.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 4.5 ptpt -66.45 136.05 55.15 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.273 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 95' ' ' ASP . 69.2 p -85.29 -177.59 6.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.577 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.0 mmt85 -60.8 -29.7 69.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.681 0.276 . . . . 0.0 111.263 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.11 9.32 10.67 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 66.68 37.84 4.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.159 0.504 . . . . 0.0 111.528 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.422 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 67.6 mt-30 -117.22 135.83 53.51 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -92.42 125.16 36.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 111.836 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 m -130.37 151.19 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.819 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.8 m -72.1 134.19 45.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.194 0.521 . . . . 0.0 111.558 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.2 t -142.68 161.45 38.05 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.188 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -142.82 156.34 44.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.473 0.654 . . . . 0.0 112.276 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.514 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -136.47 124.42 34.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.468 179.127 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -87.75 119.55 28.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.717 0.294 . . . . 0.0 110.752 -178.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.805 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -88.84 -14.86 35.94 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.462 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 6.4 p-10 -56.04 -46.54 78.83 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.462 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.1 p30 -92.36 -10.0 39.78 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 122.081 -0.387 . . . . 0.0 111.564 179.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 7.4 m80 -96.33 -64.6 1.03 Allowed 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.576 HD13 ' CD1' ' A' ' 50' ' ' TRP . 33.0 mm -80.52 147.54 6.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.541 178.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.418 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.18 171.55 13.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.772 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.556 ' C ' HD12 ' A' ' 44' ' ' ILE . 22.7 t30 -113.18 112.53 23.94 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.033 -179.321 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.736 HD13 ' HB2' ' A' ' 49' ' ' LYS . 1.9 mp -110.61 89.4 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.726 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 52.7 t0 67.55 39.39 2.84 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.402 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.74 0.75 87.63 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.674 -0.774 . . . . 0.0 113.263 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.1 m -112.63 135.28 53.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.15 0.475 . . . . 0.0 110.632 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.1 mt -77.34 118.9 20.27 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.553 0.692 . . . . 0.0 111.305 -178.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.736 ' HB2' HD13 ' A' ' 44' ' ' ILE . 17.9 mttt -136.82 162.75 32.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.851 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.774 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.2 m-90 -85.54 119.83 26.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.941 0.4 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.417 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 29.8 tt0 -173.77 148.31 1.43 Allowed Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.28 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.417 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 13.0 Cg_exo -67.22 65.53 0.67 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.317 2.011 . . . . 0.0 112.833 -179.055 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.2 p -157.63 134.35 9.91 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.823 178.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.434 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.0 109.28 15.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.125 0.488 . . . . 0.0 112.059 -178.034 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.432 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 32.7 p90 -48.45 -29.09 3.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.532 178.658 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.8 p -48.65 -19.34 0.34 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.687 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -62.36 -25.25 67.81 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 121.066 -0.254 . . . . 0.0 111.271 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.451 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -133.82 3.4 3.49 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.2 m -115.36 149.49 37.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.269 0.557 . . . . 0.0 112.34 -178.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -143.03 157.81 44.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.782 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 64.28 46.19 3.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.903 0.383 . . . . 0.0 110.512 -178.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.739 ' O ' HD22 ' A' ' 13' ' ' LEU . 72.4 m -70.12 135.33 49.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.689 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.478 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.63 152.04 42.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.768 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.468 ' CG1' HD13 ' A' ' 69' ' ' LEU . 22.0 mt -129.71 140.18 49.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.305 0.574 . . . . 0.0 111.762 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -135.6 108.92 7.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.044 179.038 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.94 -120.99 13.18 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.081 -178.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.421 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.8 p -102.11 -3.93 26.73 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.416 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.5 t -101.83 139.95 21.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-O 120.902 0.382 . . . . 0.0 111.561 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.805 HD22 HD22 ' A' ' 37' ' ' LEU . 5.6 tp -104.08 128.88 51.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.854 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.631 ' N ' HD12 ' A' ' 69' ' ' LEU . 7.5 m -118.09 127.11 53.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.417 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -151.93 153.34 33.92 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.276 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.7 m -94.59 125.83 39.49 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 78.8 m -126.18 144.56 50.72 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.62 137.31 42.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.645 178.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.0 mtp85 -92.56 144.64 25.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.706 0.289 . . . . 0.0 110.591 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.3 m -51.87 -28.06 14.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.7 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -83.43 1.95 39.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.667 0.27 . . . . 0.0 111.554 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.29 136.97 7.17 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.655 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.39 -171.27 13.69 Favored Glycine 0 C--N 1.32 -0.352 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -130.06 141.12 50.75 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.296 0.548 . . . . 0.0 111.212 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -153.93 130.67 10.8 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.232 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.2 t -93.57 134.95 35.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.681 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 92.3 p -123.24 158.33 31.12 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.298 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.1 p -123.42 146.47 47.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.257 -179.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.716 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 14.1 tt -145.41 143.1 22.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.584 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -95.79 119.13 33.73 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.971 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.545 ' HB3' HD12 ' A' ' 91' ' ' ILE . 10.9 mt -99.26 -5.65 29.46 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -178.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.803 ' OD1' HG22 ' A' ' 5' ' ' ILE . 51.8 t30 -44.75 -28.2 0.6 Allowed 'General case' 0 N--CA 1.467 0.404 0 O-C-N 122.081 -0.387 . . . . 0.0 111.982 -178.339 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.0 t -82.35 -40.06 21.91 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.774 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -72.4 -53.0 20.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -178.052 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.654 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -83.41 147.44 5.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.017 0.437 . . . . 0.0 111.339 -179.016 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 99' ' ' LYS . 11.9 tt0 -138.33 165.86 25.68 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.974 -178.759 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -108.45 100.13 9.44 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.156 0.503 . . . . 0.0 110.586 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.9 t -98.97 98.59 7.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.072 179.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.432 ' O ' HG22 ' A' ' 25' ' ' THR . 26.2 t0 53.06 33.74 15.62 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 111.752 0.278 . . . . 0.0 111.752 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.46 28.56 12.59 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.344 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.8 m -140.68 136.07 32.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.861 0.362 . . . . 0.0 111.296 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.42 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 59.3 mt -74.39 119.25 18.34 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.5 mmtt -125.17 138.23 54.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.374 -179.272 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.453 ' CE1' ' HB ' ' A' ' 90' ' ' VAL . 89.0 t80 -77.47 162.0 27.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.344 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.428 ' HG3' ' CE2' ' A' ' 100' ' ' TYR . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.886 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.716 -0.154 . . . . 0.0 112.716 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 1' ' ' LEU . 13.7 tp -112.78 -43.5 3.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.685 0.278 . . . . 0.0 111.015 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -164.4 -121.17 0.55 Allowed Glycine 0 CA--C 1.52 0.377 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.959 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 49.3 mttt 64.9 68.55 0.51 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.874 0.369 . . . . 0.0 110.949 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.446 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 30.1 p90 -93.49 -39.95 10.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.648 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.741 HG22 ' OD1' ' A' ' 88' ' ' ASN . 7.5 tp -63.49 -17.29 19.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.912 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.76 -26.82 57.75 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.943 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.9 p -118.96 20.8 12.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.283 179.093 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 65.7 m -136.34 154.74 50.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.033 0.444 . . . . 0.0 111.407 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 ptm85 -133.78 173.16 11.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.192 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 48.85 57.82 5.99 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.072 -0.513 . . . . 0.0 112.106 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.616 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.1 p -79.06 131.96 36.44 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 178.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.746 ' O ' HD12 ' A' ' 19' ' ' LEU . 6.4 pt20 -157.56 164.02 37.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.892 0.377 . . . . 0.0 111.743 -178.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.711 HD22 ' O ' ' A' ' 62' ' ' SER . 0.9 OUTLIER -97.41 136.01 38.47 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.056 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.11 143.84 47.95 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.63 -151.78 32.21 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 119.797 -1.192 . . . . 0.0 111.608 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.0 -37.5 18.9 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -178.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -142.12 36.56 1.55 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -115.51 147.29 40.83 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.985 0.421 . . . . 0.0 111.704 178.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.781 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.0 tp -120.55 123.66 43.42 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.646 ' HB2' ' HE2' ' A' ' 34' ' ' LYS . . . -118.55 143.85 46.47 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.4 172.74 15.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.522 -178.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -112.34 133.55 54.38 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 177.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 84.5 m -130.8 133.97 46.44 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 8.5 ptpt -66.51 134.86 53.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.011 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.527 HG22 ' O ' ' A' ' 95' ' ' ASP . 70.8 p -84.05 -176.2 6.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.504 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.25 -30.5 70.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.753 0.311 . . . . 0.0 111.036 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.64 10.04 8.28 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 66.89 37.77 3.9 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.151 0.5 . . . . 0.0 111.778 -179.05 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.431 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 66.6 mt-30 -120.32 135.19 55.1 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.015 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.434 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 30.4 m-85 -92.93 125.09 37.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.136 0.493 . . . . 0.0 111.708 -178.577 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 22.9 m -128.25 153.08 37.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.607 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.7 m -72.65 134.37 45.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.144 0.497 . . . . 0.0 111.807 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.5 t -144.38 161.55 38.72 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.349 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.646 ' HE2' ' HB2' ' A' ' 20' ' ' ALA . 12.1 ttmt -144.29 156.47 44.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.21 0.529 . . . . 0.0 111.895 -179.157 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.422 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.3 tp -134.91 129.76 51.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.027 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -88.98 115.48 26.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.63 0.252 . . . . 0.0 111.48 -178.331 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.878 HD22 HD22 ' A' ' 69' ' ' LEU . 4.0 mp -87.0 -14.99 40.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.511 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -46.18 79.2 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -178.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -92.23 -10.0 40.15 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 7.1 m80 -96.7 -64.93 1.0 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.548 HD11 HD22 ' A' ' 87' ' ' LEU . 21.1 mm -79.86 146.03 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.537 178.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -137.82 171.34 14.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.804 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.426 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 28.9 t30 -111.4 108.01 17.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.618 -179.336 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.5 mm -108.65 89.06 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.645 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 54.8 t0 66.13 39.0 4.47 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.305 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.14 0.47 89.58 Favored Glycine 0 CA--C 1.519 0.32 0 C-N-CA 120.872 -0.68 . . . . 0.0 113.32 179.193 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 52.6 m -110.16 136.36 49.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.077 0.439 . . . . 0.0 110.78 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.2 mt -77.23 117.52 18.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.639 0.733 . . . . 0.0 111.359 -178.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -137.57 162.54 33.5 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 114.706 -1.134 . . . . 0.0 110.354 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.731 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.9 m-90 -86.91 119.3 26.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.992 0.425 . . . . 0.0 111.072 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.42 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 15.4 tt0 -173.05 143.24 1.08 Allowed Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.658 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 32.0 Cg_endo -64.72 72.59 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.019 1.812 . . . . 0.0 112.544 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.2 p -162.85 136.01 5.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.87 -1.059 . . . . 0.0 108.882 179.364 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -83.01 109.88 17.48 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.28 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.423 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 29.4 p90 -49.95 -30.31 10.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.919 178.539 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.1 p -49.17 -18.58 0.35 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -63.22 -25.49 68.36 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.853 -0.339 . . . . 0.0 111.455 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.426 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.8 p -131.5 -0.64 3.96 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.545 179.443 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.3 m -109.72 148.62 31.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.113 0.482 . . . . 0.0 112.016 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -142.4 157.38 44.84 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.684 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 21.5 m120 63.38 45.08 5.07 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.61 -179.278 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.711 ' O ' HD22 ' A' ' 13' ' ' LEU . 67.6 m -68.0 137.37 55.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.56 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.88 152.44 42.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.801 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.534 HG21 HD13 ' A' ' 19' ' ' LEU . 35.4 mt -130.93 139.29 51.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.291 0.567 . . . . 0.0 111.932 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -136.86 110.32 7.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.82 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.73 -121.54 12.53 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.466 -0.874 . . . . 0.0 111.202 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.422 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.8 p -101.61 -4.32 26.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.603 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.1 t -101.54 141.12 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.878 HD22 HD22 ' A' ' 37' ' ' LEU . 9.3 tp -102.71 123.53 46.57 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.439 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.402 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.3 m -114.46 124.4 51.83 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.3 t -152.15 153.8 34.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.63 0.252 . . . . 0.0 111.399 -178.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 16.3 m -94.85 126.56 40.25 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 87.9 m -125.86 145.49 50.22 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -75.06 136.45 41.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.261 177.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 45.3 mtp180 -93.07 144.47 25.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.714 0.292 . . . . 0.0 110.944 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 46.8 m -52.21 -25.87 10.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.641 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -82.36 0.28 42.54 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.76 0.314 . . . . 0.0 111.174 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.45 135.38 7.03 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.89 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 113.83 -166.04 12.11 Favored Glycine 0 C--N 1.319 -0.378 0 N-CA-C 111.447 -0.661 . . . . 0.0 111.447 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -131.41 143.82 50.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 117.148 0.474 . . . . 0.0 111.295 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -154.25 130.79 10.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.267 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.0 t -94.31 134.88 36.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.664 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.6 p -123.27 158.41 31.01 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.662 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.7 p -122.64 146.63 47.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.849 0.357 . . . . 0.0 111.174 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.674 HD11 ' CH2' ' A' ' 50' ' ' TRP . 12.9 tt -145.81 143.2 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.803 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -97.1 117.29 30.97 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.853 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.651 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 11.1 mt -98.78 -4.62 32.94 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -178.469 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.741 ' OD1' HG22 ' A' ' 5' ' ' ILE . 55.7 t30 -44.77 -27.25 0.48 Allowed 'General case' 0 N--CA 1.469 0.515 0 O-C-N 122.0 -0.438 . . . . 0.0 112.101 -178.389 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.1 t -81.77 -41.94 20.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.731 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.0 m -70.72 -52.45 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -177.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.651 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -83.43 147.1 6.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 120.941 0.401 . . . . 0.0 111.58 -178.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 36.1 tt0 -137.71 164.29 29.23 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.886 -178.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -106.04 99.69 9.27 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-O 121.195 0.522 . . . . 0.0 110.697 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -98.05 97.56 6.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.29 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.527 ' O ' HG22 ' A' ' 25' ' ' THR . 30.8 t0 52.46 32.29 11.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.61 0.243 . . . . 0.0 111.617 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.38 28.42 10.61 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.823 -0.703 . . . . 0.0 113.429 179.301 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.8 t -142.07 136.24 29.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.833 0.349 . . . . 0.0 111.463 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.466 HD22 HG21 ' A' ' 91' ' ' ILE . 78.9 mt -74.35 120.51 20.02 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.718 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 17.3 mttt -126.35 145.76 50.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.949 -178.68 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -73.62 -31.62 63.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.103 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.097 -179.831 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.191 0 N-CA-C 112.534 -0.226 . . . . 0.0 112.534 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -168.07 35.25 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.903 0.382 . . . . 0.0 110.625 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -128.39 -79.61 0.26 Allowed Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.27 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 53.6 mttt 63.09 73.42 0.46 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.884 0.373 . . . . 0.0 111.242 179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 25.5 p90 -92.1 -38.46 12.17 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.409 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.817 HG22 ' OD1' ' A' ' 88' ' ' ASN . 5.1 tp -66.4 -14.6 17.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.713 0.292 . . . . 0.0 111.447 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -77.29 -27.52 53.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 0.0 110.683 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.9 p -118.68 19.11 13.3 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.258 179.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.6 m -133.1 154.48 50.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.04 0.448 . . . . 0.0 111.374 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.59 172.41 12.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.964 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 p30 49.4 57.68 6.23 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.704 HG21 ' CD1' ' A' ' 5' ' ' ILE . 40.4 p -79.85 133.17 36.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 177.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.809 ' O ' HD12 ' A' ' 19' ' ' LEU . 8.5 pt20 -158.56 163.89 36.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.592 -179.234 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.703 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.56 136.47 37.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.268 0.556 . . . . 0.0 111.167 -179.745 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.22 143.26 48.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.282 179.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.14 -150.31 37.0 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 119.884 -1.15 . . . . 0.0 111.565 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -86.29 -37.12 18.87 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -178.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.19 35.33 1.52 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -114.67 149.65 36.4 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.986 0.422 . . . . 0.0 111.679 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.809 HD12 ' O ' ' A' ' 12' ' ' GLN . 14.2 tp -122.87 123.89 42.0 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.35 143.12 47.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.877 0.37 . . . . 0.0 110.212 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.82 172.86 15.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.255 -178.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -109.36 135.08 51.0 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.6 m -130.61 131.86 45.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.154 0.502 . . . . 0.0 111.415 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 0.4 OUTLIER -66.03 137.06 56.83 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.459 -179.491 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.8 p -86.52 -178.15 6.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.481 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.3 mmt180 -60.38 -29.05 68.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.714 0.293 . . . . 0.0 111.247 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.85 9.18 10.44 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -178.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 66.77 37.29 4.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.119 0.485 . . . . 0.0 111.393 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.467 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 27.3 mm-40 -118.18 137.81 52.74 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 177.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -93.15 125.04 37.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.946 0.403 . . . . 0.0 111.548 -178.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.414 HG22 HG23 ' A' ' 25' ' ' THR . 2.4 m -128.42 150.08 33.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.733 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 20.5 t -70.92 133.65 46.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.076 0.465 . . . . 0.0 111.41 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.7 t -144.59 161.53 38.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.464 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -143.1 157.91 44.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.396 0.617 . . . . 0.0 112.049 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.433 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.1 tp -137.08 128.56 42.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.142 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -88.23 116.78 26.67 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.949 HD22 HD22 ' A' ' 69' ' ' LEU . 4.6 mp -86.27 -14.44 43.72 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.544 178.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.406 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -56.19 -48.91 75.44 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.251 0.464 . . . . 0.0 112.251 -178.461 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.83 -10.48 39.63 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 122.014 -0.429 . . . . 0.0 111.56 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.427 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 32.2 m-70 -96.07 -64.5 1.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.588 HD12 ' N ' ' A' ' 41' ' ' ILE . 2.1 mp -80.26 148.51 5.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.276 178.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.559 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -141.15 171.63 13.8 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.784 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.624 HD22 ' HA2' ' A' ' 46' ' ' GLY . 27.1 t-20 -113.19 112.29 23.53 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.324 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.835 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.5 mp -112.97 89.28 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.141 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t0 68.43 37.02 2.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.252 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.624 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 85.95 0.28 87.43 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.425 179.146 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.3 m -109.81 135.02 51.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 117.254 0.527 . . . . 0.0 110.729 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.7 mt -77.31 116.56 18.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.838 0.828 . . . . 0.0 111.335 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.835 ' HB2' HD13 ' A' ' 44' ' ' ILE . 61.0 mttt -139.42 163.57 32.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.109 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.704 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.5 m-90 -87.83 127.82 35.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.091 0.472 . . . . 0.0 112.246 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.559 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 1.5 mt-30 -172.57 152.21 2.54 Favored Pre-proline 0 N--CA 1.467 0.385 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.896 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.3 62.21 2.68 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 121.86 1.707 . . . . 0.0 112.029 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.51 135.34 10.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.633 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.403 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.77 110.99 16.8 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -177.852 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.466 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 39.5 p90 -48.32 -29.63 4.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.512 178.264 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.0 p -49.02 -17.82 0.24 Allowed 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -179.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -63.01 -28.67 70.26 Favored 'General case' 0 C--N 1.332 -0.166 0 O-C-N 122.163 -0.336 . . . . 0.0 111.141 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.1 p -128.56 -0.05 5.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.522 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.3 m -111.47 148.73 32.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.316 0.579 . . . . 0.0 112.395 -178.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -143.3 157.86 44.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.132 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 63.64 45.34 4.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.013 0.435 . . . . 0.0 110.887 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.703 ' O ' HD22 ' A' ' 13' ' ' LEU . 74.9 m -70.33 137.26 50.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.828 179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.77 151.65 41.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.4 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.556 HG21 HD13 ' A' ' 19' ' ' LEU . 57.5 mt -130.58 141.18 46.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.353 0.597 . . . . 0.0 112.094 -179.62 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -137.0 109.05 7.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.318 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.412 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.38 -119.93 12.35 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.446 -0.883 . . . . 0.0 111.689 -178.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.45 ' HB3' HG21 ' A' ' 5' ' ' ILE . 25.8 p -100.69 -4.71 27.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.592 HG13 ' O ' ' A' ' 85' ' ' ILE . 11.0 t -103.18 140.59 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-O 121.041 0.448 . . . . 0.0 112.208 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.949 HD22 HD22 ' A' ' 37' ' ' LEU . 8.0 tp -103.37 126.93 50.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.516 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.483 ' N ' HD12 ' A' ' 69' ' ' LEU . 31.8 m -115.71 125.54 52.95 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 t -151.57 153.43 34.51 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.297 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 6.2 m -95.02 126.0 40.06 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.511 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 74.6 m -126.44 145.18 50.58 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -74.77 137.3 41.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.954 178.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 49.2 mtm180 -91.93 144.49 25.41 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.348 179.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.4 m -51.98 -27.03 11.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.579 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -82.85 1.55 38.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.354 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.96 137.82 7.4 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.314 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.75 -168.16 12.49 Favored Glycine 0 C--N 1.319 -0.386 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -178.606 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -133.7 143.32 48.44 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 117.379 0.59 . . . . 0.0 111.431 -179.532 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -154.14 131.28 11.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.185 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -93.48 134.46 35.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.612 -179.401 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.6 p -121.73 158.09 29.52 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.189 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 78.7 p -122.74 144.34 49.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.383 . . . . 0.0 111.136 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.687 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.8 tt -145.13 142.93 22.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.64 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -96.86 116.18 28.72 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.401 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.632 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 3.6 mt -96.71 -4.3 41.01 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -178.667 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.817 ' OD1' HG22 ' A' ' 5' ' ' ILE . 56.8 t30 -44.45 -26.91 0.39 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.461 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.0 m -81.86 -40.98 21.65 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.704 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.8 m -72.98 -52.64 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 113.485 0.921 . . . . 0.0 113.485 -177.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.519 ' N ' HG23 ' A' ' 90' ' ' VAL . 2.7 mp -81.83 147.57 6.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.042 0.448 . . . . 0.0 111.319 -179.201 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 20.0 tt0 -139.88 166.19 25.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.013 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -106.8 99.61 9.17 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-O 121.207 0.527 . . . . 0.0 110.349 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.8 t -98.46 98.0 6.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.616 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.489 ' O ' HG22 ' A' ' 25' ' ' THR . 31.7 t0 53.57 33.23 15.86 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.93 28.41 12.11 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.766 -0.731 . . . . 0.0 113.79 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.6 m -141.38 137.89 32.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.907 0.384 . . . . 0.0 111.108 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.433 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 67.8 mt -73.91 119.66 18.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.365 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 16.3 mttt -123.92 139.27 54.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.844 -178.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.427 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 20.3 t80 -85.65 -54.43 4.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.233 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.702 179.545 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 N-CA-C 112.546 -0.221 . . . . 0.0 112.546 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 11.5 tp -166.81 120.71 1.04 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.719 0.295 . . . . 0.0 110.864 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 62.54 -92.4 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.331 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.402 ' HA ' ' ND2' ' A' ' 88' ' ' ASN . 1.8 mptm? 61.94 70.91 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.868 0.366 . . . . 0.0 110.731 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.477 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 19.2 p90 -92.04 -37.52 12.75 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.359 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.94 HG22 ' ND2' ' A' ' 88' ' ' ASN . 5.2 tp -68.12 -10.43 12.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 120.705 0.288 . . . . 0.0 111.469 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -77.28 -25.88 51.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.842 0.353 . . . . 0.0 110.798 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.3 p -118.31 -2.35 11.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.75 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.2 m -110.51 152.71 26.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.123 0.487 . . . . 0.0 111.143 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.406 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 1.2 ptm180 -132.87 172.84 12.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.606 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.408 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.4 p-10 50.13 56.97 7.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.951 0.405 . . . . 0.0 112.017 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.683 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.3 p -79.52 132.72 36.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.998 178.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.828 ' O ' HD12 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -157.19 163.3 39.0 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.281 -179.515 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.722 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.56 136.1 38.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.789 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.421 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.58 145.65 47.14 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.027 179.176 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.67 -153.4 29.11 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 119.731 -1.224 . . . . 0.0 111.196 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.2 -36.85 19.21 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.22 35.94 1.9 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 15.3 mp0 -116.67 147.66 41.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.088 0.471 . . . . 0.0 111.737 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.828 HD12 ' O ' ' A' ' 12' ' ' GLN . 13.6 tp -121.75 125.55 46.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.536 -0.756 . . . . 0.0 108.988 178.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.04 142.69 47.12 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.867 0.365 . . . . 0.0 110.104 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.11 172.17 17.25 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.118 -178.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -114.33 134.77 54.72 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 177.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 59.3 m -130.49 133.32 46.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.148 0.499 . . . . 0.0 111.693 -178.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 1.3 pttt -66.47 136.06 55.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.335 -179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 95' ' ' ASP . 46.0 p -84.51 -176.98 6.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.503 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.2 mmt180 -62.33 -29.79 70.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.145 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.74 9.78 7.29 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 66.77 37.29 4.24 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.144 0.497 . . . . 0.0 111.397 -178.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.477 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 28.2 mt-30 -118.51 137.47 53.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.088 178.241 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -94.23 126.5 39.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.898 0.38 . . . . 0.0 111.625 -178.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 25.6 m -131.04 153.0 38.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.051 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.9 m -73.16 134.11 44.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.12 0.486 . . . . 0.0 111.547 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.0 t -144.59 161.48 39.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.062 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.6 ttpt -141.4 156.84 45.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.454 0.645 . . . . 0.0 112.234 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.475 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -136.83 123.76 30.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 114.899 -1.046 . . . . 0.0 108.566 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -86.8 118.75 26.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.693 0.282 . . . . 0.0 110.673 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.798 HD11 ' CB ' ' A' ' 19' ' ' LEU . 4.3 mp -86.95 -14.98 40.22 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.491 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.1 p-10 -57.28 -43.73 83.36 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.288 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.1 p30 -91.8 -10.06 41.24 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 122.247 -0.283 . . . . 0.0 111.433 179.645 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.461 ' CD2' ' CD2' ' A' ' 100' ' ' TYR . 17.4 m80 -99.84 -64.19 1.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.614 HD11 HD22 ' A' ' 87' ' ' LEU . 26.0 mm -78.64 146.97 7.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.53 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.63 ' HB1' ' OG ' ' A' ' 53' ' ' SER . . . -139.56 172.01 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.611 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.496 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 26.7 t30 -112.74 108.25 17.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.824 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.2 mm -109.18 89.54 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.03 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.7 t70 68.3 39.54 2.27 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.138 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.3 0.71 90.04 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.903 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.8 m -110.61 137.2 48.6 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.845 0.355 . . . . 0.0 110.762 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.491 HD12 ' OG ' ' A' ' 83' ' ' SER . 11.5 mt -77.21 116.78 18.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.609 0.718 . . . . 0.0 111.281 -178.051 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -135.49 162.09 33.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.805 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.741 ' CE2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -86.21 121.55 28.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.993 0.425 . . . . 0.0 111.476 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.452 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 40.5 tt0 -174.17 150.36 1.56 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.38 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.452 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 7.3 Cg_exo -70.42 65.64 2.18 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.237 1.958 . . . . 0.0 112.369 -179.31 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.63 ' OG ' ' HB1' ' A' ' 42' ' ' ALA . 24.6 p -157.45 134.72 10.36 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.394 178.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.436 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.36 108.12 14.71 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -177.557 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.456 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 40.9 p90 -47.67 -30.69 3.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.22 178.267 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.6 p -47.26 -18.4 0.1 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.853 -179.459 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -65.08 -27.06 68.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.614 0.245 . . . . 0.0 111.535 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.496 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.5 p -129.22 -1.4 5.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.451 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -111.69 149.62 31.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.184 0.516 . . . . 0.0 111.916 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -142.19 157.58 44.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.735 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.4 m120 64.13 48.7 2.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.981 0.419 . . . . 0.0 110.657 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.722 ' O ' HD22 ' A' ' 13' ' ' LEU . 62.8 m -71.37 134.27 46.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.555 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.468 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -141.78 151.84 43.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.561 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.507 HG21 HD13 ' A' ' 19' ' ' LEU . 34.6 mt -130.4 141.52 46.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-O 121.353 0.597 . . . . 0.0 112.185 -179.786 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -137.74 109.0 6.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.887 178.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.17 -121.83 12.07 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.464 -0.874 . . . . 0.0 111.332 -178.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.42 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 31.2 p -102.47 -2.69 28.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.666 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.0 t -102.36 139.32 23.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.952 0.406 . . . . 0.0 111.592 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.792 HD22 HD22 ' A' ' 37' ' ' LEU . 6.3 tp -102.35 128.2 49.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.628 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.62 ' N ' HD12 ' A' ' 69' ' ' LEU . 4.2 m -116.8 123.92 48.29 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.1 t -151.63 153.28 34.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.608 0.242 . . . . 0.0 111.21 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.6 m -94.83 126.15 39.96 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.543 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.403 ' HB3' ' OD1' ' A' ' 43' ' ' ASN . 81.4 m -125.59 144.32 50.63 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.488 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -74.52 136.98 42.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.587 178.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -92.53 142.32 27.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.717 0.294 . . . . 0.0 110.583 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.1 m -52.13 -26.26 10.86 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.619 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -83.18 1.36 40.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.659 0.266 . . . . 0.0 111.532 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.13 133.42 6.53 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.804 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.83 -169.02 12.8 Favored Glycine 0 C--N 1.317 -0.483 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 -178.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -132.26 144.03 50.32 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 117.238 0.519 . . . . 0.0 111.413 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -154.11 129.98 10.17 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.558 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.4 t -91.82 134.67 34.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.41 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.491 ' OG ' HD12 ' A' ' 48' ' ' LEU . 29.7 p -123.42 158.04 32.06 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.402 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.0 m -122.45 145.53 48.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.02 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.677 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.9 tt -144.78 143.37 22.74 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.725 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -96.43 116.18 28.64 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.103 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.614 HD22 HD11 ' A' ' 41' ' ' ILE . 11.6 mt -96.95 -6.99 34.28 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -179.117 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.94 ' ND2' HG22 ' A' ' 5' ' ' ILE . 13.2 t-20 -44.86 -28.19 0.62 Allowed 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -178.359 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.4 m -81.98 -38.23 25.46 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.741 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.9 m -74.4 -53.46 17.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -178.107 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.611 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.2 147.63 5.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.06 0.457 . . . . 0.0 111.268 -178.942 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 9.9 tt0 -137.32 166.54 23.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.157 -178.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -107.21 99.42 8.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.121 0.486 . . . . 0.0 110.184 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.1 t -98.28 96.08 4.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.196 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.514 ' O ' HG22 ' A' ' 25' ' ' THR . 28.3 t0 53.09 33.47 15.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.655 0.264 . . . . 0.0 111.466 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.59 28.65 12.17 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.269 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 62.5 p -140.92 133.76 29.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.802 0.334 . . . . 0.0 110.912 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.437 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 77.4 mt -74.49 121.07 20.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.732 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.458 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 8.5 mttm -125.11 137.0 54.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.076 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.461 ' CD2' ' CD2' ' A' ' 40' ' ' HIS . 39.1 t80 -82.78 153.91 25.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.649 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.789 179.845 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.166 0 N-CA-C 112.444 -0.262 . . . . 0.0 112.444 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 19.0 mt -83.67 174.1 10.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.812 0.339 . . . . 0.0 110.865 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.81 147.44 48.38 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.6 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.4 ptpt -148.95 87.96 1.58 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.829 0.347 . . . . 0.0 110.727 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.454 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 14.1 p90 -92.97 -40.5 10.53 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.662 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.743 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.0 tp -63.87 -19.33 24.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.633 0.254 . . . . 0.0 111.446 -179.33 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -75.45 -26.79 58.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.819 0.342 . . . . 0.0 110.855 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.7 p -118.66 13.95 13.43 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.537 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 71.1 m -127.11 153.6 45.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.037 0.446 . . . . 0.0 111.477 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -133.1 172.58 12.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.96 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.0 p30 49.62 57.66 6.27 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.713 HG21 ' CD1' ' A' ' 5' ' ' ILE . 31.3 p -79.65 134.15 36.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.015 178.095 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.7 ' O ' HD12 ' A' ' 19' ' ' LEU . 17.9 pt20 -158.86 163.84 36.26 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.132 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.745 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.39 136.22 38.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.177 0.513 . . . . 0.0 110.991 -179.779 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.74 145.01 46.93 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.381 179.097 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.62 -152.38 30.95 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.55 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -85.89 -37.14 19.45 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.224 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.11 35.54 1.54 Allowed 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 5.8 mp0 -114.34 146.91 39.93 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.927 0.394 . . . . 0.0 111.48 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.766 ' CB ' HD11 ' A' ' 37' ' ' LEU . 14.0 tp -120.3 124.49 45.72 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.183 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.409 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . . . -121.74 144.55 48.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.94 0.4 . . . . 0.0 110.048 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.79 172.8 15.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.089 -178.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -109.78 133.98 52.53 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.426 ' SG ' HD21 ' A' ' 98' ' ' LEU . 83.0 m -130.67 134.11 46.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.191 0.52 . . . . 0.0 112.139 -178.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.6 ptpt -66.43 137.3 56.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.506 -179.573 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 95' ' ' ASP . 72.8 p -86.06 -179.52 6.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.447 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -60.36 -29.87 69.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.655 0.264 . . . . 0.0 111.134 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.66 10.39 9.38 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 66.88 39.74 3.29 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.207 0.527 . . . . 0.0 112.052 -179.23 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.432 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 68.1 mt-30 -119.96 136.03 54.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.403 -0.817 . . . . 0.0 108.853 177.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.402 ' CE1' ' HB3' ' A' ' 24' ' ' LYS . 63.7 m-85 -92.09 126.39 37.15 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.023 0.439 . . . . 0.0 111.958 -178.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 29.3 m -131.09 152.49 37.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.163 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.3 t -72.96 134.39 44.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.135 0.493 . . . . 0.0 111.667 -179.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 t -145.76 161.57 39.62 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.362 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.409 ' HG3' ' HB2' ' A' ' 20' ' ' ALA . 20.2 ttpt -144.04 157.17 44.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.353 0.597 . . . . 0.0 112.139 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.412 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -135.21 129.4 50.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.834 179.498 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -88.52 116.44 26.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.558 0.218 . . . . 0.0 111.414 -178.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.806 HD22 HD22 ' A' ' 69' ' ' LEU . 4.2 mp -87.58 -15.91 36.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.325 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -47.28 73.44 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -178.439 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.415 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 3.2 m-20 -92.26 -10.33 38.9 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 122.169 -0.332 . . . . 0.0 111.755 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.434 ' HB3' HD12 ' A' ' 41' ' ' ILE . 21.7 m-70 -96.29 -64.9 1.01 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.789 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.63 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.9 mp -82.53 147.71 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.419 178.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -141.3 171.99 13.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.815 -0.629 . . . . 0.0 112.081 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.633 HD22 ' HA2' ' A' ' 46' ' ' GLY . 26.1 t-20 -112.87 113.21 25.18 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.941 -179.291 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.806 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.5 mp -113.59 89.49 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.937 0.399 . . . . 0.0 111.141 179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 50.1 t0 69.77 37.26 1.88 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.449 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.633 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 86.03 0.75 87.11 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.643 -0.789 . . . . 0.0 113.293 179.244 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 39.8 m -112.84 135.97 53.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 117.198 0.499 . . . . 0.0 110.8 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.444 HD12 ' OG ' ' A' ' 83' ' ' SER . 18.8 mt -77.18 117.19 18.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.635 0.731 . . . . 0.0 111.733 -177.706 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.806 ' HB2' HD13 ' A' ' 44' ' ' ILE . 30.0 mmtt -137.82 162.86 32.84 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.641 179.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.875 ' CH2' HD11 ' A' ' 85' ' ' ILE . 3.6 m-90 -86.51 125.06 33.49 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.031 0.443 . . . . 0.0 111.99 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.404 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 12.2 tt0 -175.85 149.09 1.01 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.917 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.415 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 7.7 Cg_exo -69.04 66.75 1.34 Allowed 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.981 1.788 . . . . 0.0 112.061 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -156.81 131.38 8.74 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.184 179.096 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.68 109.36 15.15 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.258 0.552 . . . . 0.0 112.245 -177.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 41.1 p90 -48.15 -31.23 5.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.723 178.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.5 p -49.69 -18.28 0.44 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.676 -179.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -62.06 -30.18 70.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.597 0.237 . . . . 0.0 111.013 -179.056 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.0 p -126.74 -3.39 6.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.289 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.2 m -108.14 148.99 29.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.216 0.532 . . . . 0.0 112.118 -178.594 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.8 p90 -142.96 157.67 44.34 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.053 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 63.36 44.11 5.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.007 0.432 . . . . 0.0 110.728 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.745 ' O ' HD22 ' A' ' 13' ' ' LEU . 73.3 m -68.58 136.63 53.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.618 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.417 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.47 152.1 42.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.508 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.47 HG21 HD13 ' A' ' 19' ' ' LEU . 39.4 mt -129.01 139.68 51.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.238 0.542 . . . . 0.0 111.866 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -134.12 107.86 7.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.44 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.99 -120.19 13.4 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.4 -0.905 . . . . 0.0 111.3 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.3 p -99.88 -4.04 31.17 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.492 HG13 ' O ' ' A' ' 85' ' ' ILE . 12.6 t -103.15 140.09 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.806 HD22 HD22 ' A' ' 37' ' ' LEU . 8.5 tp -103.16 125.57 49.92 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.573 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.454 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -115.3 125.74 53.64 Favored 'General case' 0 N--CA 1.461 0.108 0 N-CA-C 110.094 -0.335 . . . . 0.0 110.094 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.3 t -151.86 153.59 34.5 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.69 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 10.7 m -95.53 126.12 40.59 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.453 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.493 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 70.8 m -127.45 146.7 50.4 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -178.275 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -75.27 137.1 40.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.108 178.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 30.5 mtm180 -91.98 143.98 25.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.19 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 14.2 m -51.83 -27.17 11.64 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -179.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -82.39 1.81 35.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.694 0.283 . . . . 0.0 111.436 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.92 136.04 7.54 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.817 179.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.18 -166.85 12.23 Favored Glycine 0 C--N 1.319 -0.362 0 N-CA-C 111.658 -0.577 . . . . 0.0 111.658 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -133.32 143.09 48.79 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.979 0.419 . . . . 0.0 111.163 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -154.3 132.95 12.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.119 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.3 t -94.22 134.38 36.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.842 0.353 . . . . 0.0 111.656 -179.473 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.444 ' OG ' HD12 ' A' ' 48' ' ' LEU . 23.5 p -119.8 157.76 27.96 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.192 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.7 m -121.44 142.38 50.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.916 0.389 . . . . 0.0 111.088 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.875 HD11 ' CH2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -147.78 144.51 19.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.613 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.753 ' N ' HD13 ' A' ' 85' ' ' ILE . 15.0 t0 -101.05 121.33 41.61 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.285 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.733 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 2.3 mt -100.66 -3.22 30.77 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -179.405 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.743 ' OD1' HG22 ' A' ' 5' ' ' ILE . 35.5 t30 -45.3 -26.92 0.58 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.706 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.91 -42.12 24.77 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.666 HG11 ' CE2' ' A' ' 50' ' ' TRP . 4.1 m -72.63 -51.32 28.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -177.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.513 ' N ' HG23 ' A' ' 90' ' ' VAL . 2.7 mp -81.78 147.3 6.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.037 0.446 . . . . 0.0 111.347 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 99' ' ' LYS . 3.9 tt0 -138.62 166.8 23.42 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.972 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -107.69 99.93 9.37 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.191 0.52 . . . . 0.0 110.855 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.3 t -98.89 97.14 5.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.13 179.218 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.476 ' O ' HG22 ' A' ' 25' ' ' THR . 25.8 t0 53.79 33.13 16.24 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.7 28.4 12.53 Favored Glycine 0 CA--C 1.518 0.271 0 C-N-CA 120.585 -0.817 . . . . 0.0 113.206 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.9 m -141.41 135.48 30.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.867 0.365 . . . . 0.0 111.318 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.426 HD21 ' SG ' ' A' ' 23' ' ' CYS . 28.1 mt -74.39 119.4 18.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.44 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.404 ' O ' ' N ' ' A' ' 92' ' ' GLU . 0.3 OUTLIER -125.31 135.64 52.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.321 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.417 ' CD1' ' N ' ' A' ' 101' ' ' GLU . 8.5 t80 -82.27 146.26 29.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.678 178.799 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . 0.417 ' N ' ' CD1' ' A' ' 100' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.083 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 N-CA-C 112.786 -0.125 . . . . 0.0 112.786 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.474 ' C ' HD12 ' A' ' 1' ' ' LEU . 2.2 pp -175.37 172.56 2.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.586 0.231 . . . . 0.0 110.746 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 89.33 -110.1 3.67 Favored Glycine 0 CA--C 1.521 0.417 0 C-N-CA 120.563 -0.827 . . . . 0.0 112.214 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.8 mmtp 62.16 64.84 0.93 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.767 0.318 . . . . 0.0 111.051 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -92.0 -41.72 10.39 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.733 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.949 HG22 ' ND2' ' A' ' 88' ' ' ASN . 4.4 tp -62.48 -21.11 26.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.389 -179.797 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -72.15 -24.28 61.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.744 0.307 . . . . 0.0 110.598 179.056 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.6 p -119.09 -3.99 10.6 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 86.3 m -107.19 152.07 24.56 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.811 0.339 . . . . 0.0 111.188 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -131.65 173.25 11.32 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.719 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 47.1 57.73 5.46 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.78 HG21 ' CD1' ' A' ' 5' ' ' ILE . 82.1 p -78.82 132.46 36.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.872 178.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.716 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.0 pt20 -158.57 164.34 36.17 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.959 0.409 . . . . 0.0 111.667 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.645 HD22 ' O ' ' A' ' 62' ' ' SER . 0.9 OUTLIER -97.5 135.8 38.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.497 -179.315 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.13 145.1 46.25 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.257 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 56.64 -150.27 27.16 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.318 -0.944 . . . . 0.0 111.425 -178.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.35 -37.82 18.08 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.789 0.662 . . . . 0.0 112.789 -178.106 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.449 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.9 p -141.17 37.1 1.73 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -114.66 148.75 37.74 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.943 0.401 . . . . 0.0 111.869 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.813 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.1 tp -121.89 122.35 39.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.191 179.198 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.73 143.43 46.22 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.38 172.68 16.13 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -113.63 133.36 55.34 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.555 ' SG ' HD21 ' A' ' 98' ' ' LEU . 54.7 m -130.47 132.78 45.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.148 0.499 . . . . 0.0 111.519 -178.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -64.84 137.95 58.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.671 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.403 HG22 ' O ' ' A' ' 95' ' ' ASP . 52.6 p -86.6 -177.42 6.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.771 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.8 mtp85 -61.48 -29.36 69.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.028 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.43 8.84 12.59 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 67.04 36.83 4.02 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.163 0.506 . . . . 0.0 111.274 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -117.07 134.53 54.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -90.99 124.92 35.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.119 0.485 . . . . 0.0 111.817 -178.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.6 m -130.16 150.86 35.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.635 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.7 t -72.03 136.57 46.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.345 0.593 . . . . 0.0 111.776 -178.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.7 t -145.34 162.35 37.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.212 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.414 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.9 OUTLIER -144.7 156.1 43.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.537 0.685 . . . . 0.0 111.92 -179.172 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.513 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -135.38 126.8 45.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.633 179.173 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -87.58 114.65 24.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.703 0.287 . . . . 0.0 110.807 -178.111 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.891 HD22 HD22 ' A' ' 69' ' ' LEU . 3.6 mp -86.15 -15.51 40.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.952 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -46.04 78.29 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.631 -0.428 . . . . 0.0 111.591 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.55 -10.2 41.49 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.45 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 30.3 m-70 -96.61 -60.34 1.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.525 HD13 ' CD1' ' A' ' 50' ' ' TRP . 32.8 mm -81.03 146.75 6.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.571 178.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.409 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -139.56 170.14 16.45 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.395 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.68 HD22 ' HA2' ' A' ' 46' ' ' GLY . 23.1 t-20 -111.92 108.69 18.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.86 -179.249 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 48.2 mm -108.51 88.76 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.791 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 53.8 t0 66.43 39.42 3.94 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.827 0.346 . . . . 0.0 111.563 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.68 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 83.78 0.38 89.79 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 121.007 -0.616 . . . . 0.0 113.404 179.422 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.0 m -109.02 136.33 48.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 117.009 0.405 . . . . 0.0 110.958 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.479 HD22 HG21 ' A' ' 41' ' ' ILE . 12.6 mt -77.57 117.03 18.61 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.519 0.676 . . . . 0.0 111.408 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.7 mmtt -138.39 163.51 31.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.607 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.795 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 7.4 m-90 -84.77 124.27 31.37 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.976 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.05 146.78 1.43 Allowed Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.848 -178.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -70.56 65.62 2.26 Favored 'Trans proline' 0 C--N 1.358 1.044 0 C-N-CA 122.464 2.11 . . . . 0.0 111.571 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.409 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.1 p -159.62 132.11 6.61 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.467 -1.242 . . . . 0.0 107.998 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.57 109.69 15.34 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -177.616 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.449 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.0 p90 -48.64 -30.31 5.3 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.974 177.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 35.4 p -49.92 -18.76 0.56 Allowed 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -63.1 -26.43 68.83 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.818 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.9 p -129.76 0.72 4.88 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.302 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.5 m -111.84 148.16 34.21 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.321 0.582 . . . . 0.0 112.268 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 35.5 p90 -141.7 157.99 44.37 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.528 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 64.3 42.56 5.25 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.838 0.351 . . . . 0.0 110.959 -179.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.645 ' O ' HD22 ' A' ' 13' ' ' LEU . 55.0 m -68.57 137.88 54.66 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.498 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.84 150.99 39.32 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.878 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.48 HG13 ' HB2' ' A' ' 13' ' ' LEU . 21.4 mt -129.09 140.24 49.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.47 0.652 . . . . 0.0 112.34 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -137.84 108.85 6.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.036 179.293 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.413 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 69.59 -122.64 12.44 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.322 -0.942 . . . . 0.0 111.145 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.405 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 24.6 p -100.91 -5.46 26.0 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.491 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 85' ' ' ILE . 3.2 t -101.1 140.77 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 120.995 0.426 . . . . 0.0 111.845 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.891 HD22 HD22 ' A' ' 37' ' ' LEU . 9.0 tp -104.28 127.61 51.94 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.655 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.469 ' N ' HD12 ' A' ' 69' ' ' LEU . 6.0 m -116.28 123.81 48.61 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.865 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.3 t -151.47 153.28 34.33 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.242 -0.183 . . . . 0.0 111.304 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.5 m -95.45 126.11 40.52 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.498 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 72.7 m -125.8 145.16 50.34 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -75.78 136.84 40.26 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.598 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 45.3 mtm180 -91.78 146.19 23.96 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.634 0.254 . . . . 0.0 110.693 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.4 m -52.25 -30.39 27.47 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -82.26 1.52 36.33 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.481 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.43 137.04 6.75 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.481 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 118.45 -176.43 16.11 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -127.73 141.58 51.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.576 0.688 . . . . 0.0 110.903 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -153.84 128.8 9.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.015 0.436 . . . . 0.0 110.665 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -92.18 135.48 33.96 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.894 -179.325 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.3 p -122.46 158.22 30.24 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.102 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 58.2 m -124.95 146.26 49.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.882 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.795 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 12.2 tt -146.34 143.69 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.769 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -95.41 119.72 34.39 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.386 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.562 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 7.1 mt -100.23 -5.81 27.0 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.949 ' ND2' HG22 ' A' ' 5' ' ' ILE . 11.1 t-20 -44.5 -29.1 0.66 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.427 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.13 -38.37 27.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.726 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -74.42 -52.43 19.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -178.017 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.608 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -82.81 146.37 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-O 120.859 0.362 . . . . 0.0 111.866 -178.689 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.405 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 21.4 tt0 -135.75 164.04 28.8 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.223 -178.655 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -107.05 99.75 9.28 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.38 0.61 . . . . 0.0 111.019 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 52.4 t -97.02 97.07 5.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.867 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.403 ' O ' HG22 ' A' ' 25' ' ' THR . 15.1 t0 51.65 33.3 10.57 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.03 28.75 9.63 Favored Glycine 0 C--N 1.329 0.168 0 C-N-CA 120.444 -0.884 . . . . 0.0 113.104 178.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 69.8 m -142.07 135.21 28.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.89 0.376 . . . . 0.0 111.035 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.555 HD21 ' SG ' ' A' ' 23' ' ' CYS . 44.5 mt -75.11 121.89 22.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.192 -179.483 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.1 mttm -126.59 134.35 50.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.118 0.485 . . . . 0.0 112.178 -179.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.45 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 10.1 t80 -87.16 114.58 23.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.43 179.333 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.944 -179.694 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.066 0 N-CA-C 112.596 -0.202 . . . . 0.0 112.596 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 8.2 mt -98.31 -74.97 0.56 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.691 0.281 . . . . 0.0 110.8 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.06 160.95 53.26 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.78 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.6 mttt -155.31 83.4 1.06 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.52 0.2 . . . . 0.0 110.908 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.434 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 16.0 p90 -93.5 -41.07 9.98 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.781 ' CD1' HG21 ' A' ' 11' ' ' THR . 8.2 tp -61.41 -20.73 23.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -74.12 -25.28 59.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.311 179.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.5 p -118.75 -5.95 10.63 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.667 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 66.3 m -104.91 152.77 22.24 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.08 0.467 . . . . 0.0 111.122 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -132.18 172.86 11.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.963 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 47.33 58.33 4.98 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.015 0.436 . . . . 0.0 111.721 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.781 HG21 ' CD1' ' A' ' 5' ' ' ILE . 54.4 p -79.11 130.27 35.33 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.664 178.639 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.649 ' O ' HD12 ' A' ' 19' ' ' LEU . 18.0 pt20 -156.67 164.13 38.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.778 -178.612 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.7 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.45 136.89 37.23 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.918 -179.902 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.82 144.23 48.45 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 60.27 -152.63 36.95 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 119.818 -1.182 . . . . 0.0 111.589 -179.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.7 m -86.64 -36.32 18.85 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.43 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.9 p -142.65 34.67 1.43 Allowed 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -178.697 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -113.51 151.22 31.82 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.957 0.408 . . . . 0.0 112.081 178.142 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.825 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.4 tp -124.85 124.88 43.02 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.185 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.411 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . . . -120.55 143.34 48.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.69 172.74 15.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.176 -178.309 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -114.43 133.94 55.36 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 32.3 m -130.74 132.98 45.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.114 0.483 . . . . 0.0 111.877 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 10.6 ptpt -65.74 137.83 57.53 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.435 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 95' ' ' ASP . 54.7 p -85.16 -176.31 6.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.575 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -62.34 -30.12 70.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.915 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.51 9.02 10.1 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 66.95 37.9 3.77 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.035 0.445 . . . . 0.0 111.806 -178.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.402 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 9.2 mt-30 -118.77 135.66 54.39 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 177.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -90.6 124.98 35.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.921 0.391 . . . . 0.0 111.995 -178.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.9 m -129.79 148.54 33.21 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.755 179.398 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.3 m -70.25 135.1 48.67 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.22 0.533 . . . . 0.0 111.959 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -144.62 161.81 38.22 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.344 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.411 ' HG3' ' HB2' ' A' ' 20' ' ' ALA . 28.7 ttpt -142.92 157.43 44.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.531 0.682 . . . . 0.0 112.333 -179.017 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.448 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -137.12 126.84 37.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.039 179.826 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -88.47 115.0 25.67 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.886 0.374 . . . . 0.0 111.535 -178.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.825 HD11 ' CB ' ' A' ' 19' ' ' LEU . 2.8 mp -85.66 -16.42 39.18 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.543 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.403 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -55.84 -48.15 75.99 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.637 0.256 . . . . 0.0 111.214 -179.047 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.403 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.2 OUTLIER -91.47 -10.43 40.89 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.736 -0.386 . . . . 0.0 111.594 179.515 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -95.05 -66.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.818 HD12 HD23 ' A' ' 37' ' ' LEU . 45.3 mt -79.85 151.19 4.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.747 178.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.35 172.28 12.91 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.029 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.635 HD22 ' HA2' ' A' ' 46' ' ' GLY . 21.6 t-20 -109.2 109.68 20.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.809 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 44.7 mm -110.7 88.93 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.637 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.7 t70 68.15 39.84 2.31 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.604 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.635 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 83.15 1.14 90.52 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 120.625 -0.798 . . . . 0.0 113.094 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.3 m -112.54 137.05 51.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.88 0.371 . . . . 0.0 110.953 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 52.1 mt -76.66 116.07 17.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.548 0.69 . . . . 0.0 110.58 -178.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -135.18 161.96 33.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.609 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.74 ' CE2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -87.78 120.89 29.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.991 0.424 . . . . 0.0 111.512 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.435 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 20.2 tt0 -175.25 143.73 0.76 Allowed Pre-proline 0 N--CA 1.465 0.28 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.823 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.435 ' HD2' ' HG3' ' A' ' 51' ' ' GLN . 33.6 Cg_endo -64.25 75.71 0.18 Allowed 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 121.983 1.789 . . . . 0.0 112.91 -179.008 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -165.68 133.5 2.98 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.332 179.126 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.07 110.0 16.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.231 0.539 . . . . 0.0 112.151 -178.022 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.2 p90 -49.58 -29.16 6.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.573 178.451 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 61.5 p -49.6 -17.7 0.35 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -62.51 -28.14 69.64 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.595 0.235 . . . . 0.0 111.216 -179.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.4 p -129.84 -1.25 4.76 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 179.682 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.9 m -109.49 147.62 32.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.332 0.587 . . . . 0.0 112.482 -178.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -142.92 158.52 43.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.605 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 64.31 43.53 4.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.858 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.7 ' O ' HD22 ' A' ' 13' ' ' LEU . 74.3 m -68.64 137.06 53.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.931 179.646 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.436 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -144.0 152.93 41.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.291 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.498 ' CG1' HD13 ' A' ' 69' ' ' LEU . 43.5 mt -130.47 140.87 47.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.254 0.549 . . . . 0.0 111.717 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -137.17 107.96 6.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.668 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.71 -122.29 11.84 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.615 -0.802 . . . . 0.0 111.631 -178.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.5 p -101.08 -5.33 25.87 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.47 HG13 ' O ' ' A' ' 85' ' ' ILE . 10.6 t -101.41 139.56 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 120.882 0.372 . . . . 0.0 111.672 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.759 HD22 HD22 ' A' ' 37' ' ' LEU . 9.8 tp -101.67 127.73 48.29 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.675 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.477 ' N ' HD12 ' A' ' 69' ' ' LEU . 7.2 m -116.75 123.12 46.39 Favored 'General case' 0 N--CA 1.461 0.099 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.1 t -151.96 153.99 35.17 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.748 -178.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.5 m -94.34 125.66 39.12 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 178.855 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.481 ' HB3' ' ND2' ' A' ' 43' ' ' ASN . 88.4 m -125.61 142.87 51.28 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.228 0.537 . . . . 0.0 112.445 -178.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -74.46 138.5 43.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.728 178.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.5 mtp180 -91.43 144.56 25.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.629 0.252 . . . . 0.0 110.629 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 24.6 m -52.62 -27.65 17.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.326 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -82.16 2.45 31.45 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.678 0.275 . . . . 0.0 111.208 179.722 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.78 136.46 6.7 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.726 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.59 -170.24 13.22 Favored Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 111.245 -0.742 . . . . 0.0 111.245 -178.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -130.73 142.36 50.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 117.23 0.515 . . . . 0.0 111.226 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -154.0 130.15 10.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.459 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.4 t -93.39 134.9 35.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.037 0.446 . . . . 0.0 111.743 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 89.7 p -122.22 158.49 29.33 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.344 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.4 m -122.76 146.05 47.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.823 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.725 HD11 ' CH2' ' A' ' 50' ' ' TRP . 9.7 tt -147.76 143.46 19.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.037 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -97.07 119.82 36.27 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.684 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.535 ' HB3' HD12 ' A' ' 91' ' ' ILE . 9.4 mt -100.71 -6.41 25.08 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -178.548 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.778 ' OD1' HG22 ' A' ' 5' ' ' ILE . 41.9 t30 -45.09 -29.72 0.95 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -178.608 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.3 t -81.28 -39.45 25.21 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.74 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.8 m -72.68 -52.1 24.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.632 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.85 147.33 6.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 0.0 110.764 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -138.49 165.94 25.55 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.097 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 29.0 t30 -106.59 99.7 9.26 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.221 0.534 . . . . 0.0 110.27 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -98.54 95.32 4.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.885 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.48 ' O ' HG22 ' A' ' 25' ' ' THR . 33.9 t0 52.13 32.61 10.76 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.573 0.225 . . . . 0.0 111.58 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.78 28.56 10.05 Favored Glycine 0 C--N 1.329 0.155 0 C-N-CA 120.593 -0.813 . . . . 0.0 113.635 178.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.1 m -141.65 134.33 28.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.932 0.366 . . . . 0.0 110.632 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.425 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 82.6 mt -73.26 120.6 19.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.678 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.407 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 11.7 mttt -125.91 141.07 52.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.136 0.493 . . . . 0.0 112.276 -178.585 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -80.85 76.04 7.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.31 179.38 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.173 -0.918 . . . . 0.0 111.06 -179.566 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.187 0 N-CA-C 112.45 -0.26 . . . . 0.0 112.45 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 1' ' ' LEU . 4.3 mm? -64.39 -178.31 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.748 0.309 . . . . 0.0 110.804 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -137.65 -58.06 0.05 OUTLIER Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.428 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.9 mttt 60.25 71.15 0.58 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.865 0.364 . . . . 0.0 110.844 -179.91 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.44 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 18.5 p90 -92.89 -39.33 11.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.789 -179.644 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.771 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.0 tp -63.4 -18.16 21.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.728 0.299 . . . . 0.0 111.495 -179.655 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -74.8 -24.31 58.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.978 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.1 p -118.71 15.1 13.57 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.649 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 56.5 m -131.47 154.09 49.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.171 0.51 . . . . 0.0 111.304 -179.655 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.4 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 6.3 ptt180 -132.76 173.19 11.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.676 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.419 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.7 p-10 48.95 56.71 7.34 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.648 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.0 p -79.37 133.75 36.59 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.565 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.677 ' O ' HD12 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -158.09 164.21 36.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.845 -178.911 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.714 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.41 136.35 37.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.994 -179.859 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.5 144.62 46.91 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.454 -0.794 . . . . 0.0 108.993 178.977 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.15 -152.16 29.45 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.847 -1.168 . . . . 0.0 111.846 -179.09 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.73 -36.7 20.01 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.343 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -142.53 35.92 1.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.8 mp0 -114.5 147.53 39.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.199 0.523 . . . . 0.0 111.689 179.09 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.768 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.3 tp -120.93 123.99 43.84 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.394 179.287 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.572 ' HB2' ' HE2' ' A' ' 34' ' ' LYS . . . -121.42 142.98 49.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.961 0.41 . . . . 0.0 110.105 179.712 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.59 172.64 16.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.945 -178.788 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -111.82 133.73 53.84 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 176.841 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.3 m -130.61 133.95 46.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.072 0.463 . . . . 0.0 111.66 -178.966 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 8.1 ptpt -67.11 137.49 56.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.704 -179.479 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.511 HG22 ' O ' ' A' ' 95' ' ' ASP . 72.1 p -85.59 -179.19 6.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.402 179.772 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -60.63 -29.77 69.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.659 0.266 . . . . 0.0 111.12 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.58 9.36 9.56 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -178.948 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 67.04 38.52 3.46 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.146 0.498 . . . . 0.0 111.911 -179.014 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.402 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 12.6 mm100 -119.53 134.95 54.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.515 -0.766 . . . . 0.0 108.968 178.06 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -92.25 124.94 36.69 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.025 0.44 . . . . 0.0 111.821 -178.62 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.2 m -129.87 150.46 34.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.735 179.667 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.8 p -71.25 134.4 46.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.239 0.542 . . . . 0.0 111.725 -178.737 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.3 t -142.74 161.86 36.97 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.295 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.572 ' HE2' ' HB2' ' A' ' 20' ' ' ALA . 17.6 ttmt -143.67 156.18 44.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.481 0.658 . . . . 0.0 112.187 -179.07 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.588 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -136.53 124.94 35.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 114.998 -1.001 . . . . 0.0 108.501 179.142 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -88.24 119.02 28.24 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.709 0.29 . . . . 0.0 111.294 -177.973 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.829 HD22 HD22 ' A' ' 69' ' ' LEU . 4.0 mp -89.04 -14.72 35.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.808 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.0 p-10 -57.87 -43.44 85.99 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.754 -178.467 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.423 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.5 OUTLIER -92.77 -10.52 36.64 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.944 -0.472 . . . . 0.0 111.611 178.691 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 9.3 m80 -97.98 -64.2 1.06 Allowed 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.913 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.668 HD11 HD22 ' A' ' 87' ' ' LEU . 31.5 mm -80.07 145.73 8.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.444 178.764 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.457 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -137.92 171.46 14.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.5 -179.811 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.549 ' C ' HD12 ' A' ' 44' ' ' ILE . 20.2 t30 -113.12 111.71 22.58 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.251 -178.968 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.761 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.2 mp -112.7 95.03 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.394 179.192 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.3 t0 64.12 38.06 8.6 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.078 -179.561 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.08 11.63 82.17 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.218 179.374 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.7 m -120.4 136.49 54.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.024 0.412 . . . . 0.0 110.721 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.59 HD22 HG21 ' A' ' 41' ' ' ILE . 25.6 mt -77.42 118.1 19.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.559 0.695 . . . . 0.0 111.624 -177.976 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.761 ' HB2' HD13 ' A' ' 44' ' ' ILE . 25.6 mttt -139.15 163.42 32.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.006 -179.916 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.822 ' CH2' HD11 ' A' ' 85' ' ' ILE . 4.8 m-90 -85.4 119.0 25.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.956 0.408 . . . . 0.0 111.78 -179.413 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.457 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 18.0 mt-30 -169.4 151.45 4.51 Favored Pre-proline 0 N--CA 1.468 0.425 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.5 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.75 60.82 2.91 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 121.975 1.783 . . . . 0.0 112.394 -179.744 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.7 p -153.43 135.75 14.96 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.442 -0.799 . . . . 0.0 108.89 179.123 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -81.03 113.06 18.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -177.95 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.424 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 48.5 p90 -52.57 -33.49 46.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.414 178.316 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 60.1 p -48.97 -21.29 0.64 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.702 -179.11 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -62.0 -25.26 67.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.62 0.248 . . . . 0.0 110.898 -179.278 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.418 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -127.71 -2.24 6.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.127 178.797 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.8 m -111.09 148.36 32.83 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.25 0.548 . . . . 0.0 112.369 -178.277 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 41.3 p90 -140.12 157.33 45.8 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.053 179.538 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 41.1 m-20 62.99 45.15 5.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.059 0.457 . . . . 0.0 110.444 -178.989 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.714 ' O ' HD22 ' A' ' 13' ' ' LEU . 67.3 m -70.04 136.54 50.44 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.658 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.44 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -143.57 154.0 43.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.134 -179.618 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.522 HD13 HD13 ' A' ' 19' ' ' LEU . 47.0 mt -130.8 140.12 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.59 179.526 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -134.76 108.68 8.1 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.159 -0.928 . . . . 0.0 108.549 178.908 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.9 -119.68 11.26 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.327 -0.939 . . . . 0.0 111.193 -178.203 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.417 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 26.7 p -102.83 -3.49 26.24 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.411 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.53 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.3 t -101.55 137.58 28.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.93 0.395 . . . . 0.0 111.844 -179.835 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.829 HD22 HD22 ' A' ' 37' ' ' LEU . 9.3 tp -101.03 124.79 47.29 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.781 179.536 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.4 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.6 m -114.87 126.77 55.19 Favored 'General case' 0 CA--C 1.521 -0.144 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.349 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 t -151.68 153.62 34.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.73 0.3 . . . . 0.0 111.282 -179.127 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.6 m -94.3 125.61 39.04 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.703 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 85.9 m -128.55 147.2 50.69 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.44 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -75.48 136.79 40.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.179 178.505 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -91.7 144.05 25.92 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 179.282 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.3 m -52.19 -28.58 18.79 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.053 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -80.8 2.2 27.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.676 0.274 . . . . 0.0 111.504 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.03 135.06 6.7 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.561 179.99 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.5 -168.72 12.99 Favored Glycine 0 C--N 1.318 -0.442 0 N-CA-C 111.612 -0.595 . . . . 0.0 111.612 -179.0 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -131.2 141.14 50.01 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.877 0.339 . . . . 0.0 110.992 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -154.6 132.66 11.68 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.653 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -94.44 134.55 36.84 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.784 -179.367 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.5 p -121.46 157.99 29.38 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.897 0.38 . . . . 0.0 110.63 179.696 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 8.1 p -120.76 143.92 48.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.328 -179.511 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.822 HD11 ' CH2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -146.83 145.5 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.333 179.563 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.777 ' N ' HD13 ' A' ' 85' ' ' ILE . 21.0 t0 -101.5 121.54 42.15 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.422 -179.479 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.668 HD22 HD11 ' A' ' 41' ' ' ILE . 4.3 mt -103.46 -2.88 26.16 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -178.897 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.771 ' OD1' HG22 ' A' ' 5' ' ' ILE . 52.9 t30 -44.87 -27.31 0.51 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.388 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.4 m -81.37 -39.13 25.49 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.64 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.644 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.7 m -75.3 -52.45 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -177.668 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.506 ' N ' HG23 ' A' ' 90' ' ' VAL . 2.6 mp -80.52 145.57 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.895 0.378 . . . . 0.0 110.969 -179.148 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -136.84 165.97 24.71 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.343 -178.476 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -105.9 99.28 8.88 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.116 0.484 . . . . 0.0 110.34 179.999 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.505 HG11 ' HE3' ' A' ' 99' ' ' LYS . 38.2 t -98.59 95.49 4.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.108 179.564 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.511 ' O ' HG22 ' A' ' 25' ' ' THR . 24.7 t0 55.35 31.88 17.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.626 0.251 . . . . 0.0 111.559 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.07 28.21 12.29 Favored Glycine 0 C--N 1.329 0.158 0 C-N-CA 120.745 -0.74 . . . . 0.0 113.156 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 74.0 m -140.3 135.09 31.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.757 0.313 . . . . 0.0 110.801 179.776 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 66.6 mt -73.48 121.19 20.16 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.085 -179.652 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.505 ' HE3' HG11 ' A' ' 94' ' ' VAL . 17.0 mttt -124.78 126.3 45.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.07 0.462 . . . . 0.0 111.572 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.414 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 56.0 t80 -77.14 149.81 35.61 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.637 179.837 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.799 -179.81 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.189 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.522 HD23 ' O ' ' A' ' 1' ' ' LEU . 2.7 tt -172.34 -47.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.715 0.293 . . . . 0.0 111.044 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -169.04 -110.71 0.23 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.71 -179.94 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 38.8 mttt 63.41 64.42 0.82 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.001 0.429 . . . . 0.0 110.554 -179.809 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.475 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 17.5 p90 -91.02 -39.19 12.34 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.584 -179.602 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.796 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.2 tp -65.45 -14.68 17.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.68 0.276 . . . . 0.0 111.631 -179.447 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -74.91 -24.64 58.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.819 0.342 . . . . 0.0 110.717 179.424 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.4 p -118.65 -2.77 10.91 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.495 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 68.0 m -108.88 150.3 27.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.084 0.469 . . . . 0.0 111.236 -179.526 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.429 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.4 ptm180 -132.18 172.52 12.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.779 -179.861 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.429 ' OD1' ' O ' ' A' ' 9' ' ' ARG . 5.7 p-10 48.71 58.26 5.47 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.908 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.714 HG21 ' CD1' ' A' ' 5' ' ' ILE . 42.6 p -79.25 132.15 36.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.75 178.65 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.707 ' O ' HD12 ' A' ' 19' ' ' LEU . 13.4 pt20 -156.13 163.28 39.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.253 -179.228 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.752 HD22 ' O ' ' A' ' 62' ' ' SER . 0.8 OUTLIER -97.65 135.7 39.09 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.903 -179.754 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.54 144.31 48.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.12 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.07 -153.07 31.45 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.764 -1.208 . . . . 0.0 111.321 -178.761 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.55 -37.24 19.83 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -178.243 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.461 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.92 36.67 1.59 Allowed 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.201 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.1 mp0 -114.09 144.29 43.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.968 0.413 . . . . 0.0 111.317 178.617 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.799 ' CB ' HD11 ' A' ' 37' ' ' LEU . 13.4 tp -117.33 123.83 47.47 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.672 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.38 142.17 47.44 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.445 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.01 172.22 17.27 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.152 -178.591 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -116.06 133.58 55.87 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.751 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 32.1 m -130.73 134.52 46.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.131 0.491 . . . . 0.0 111.573 -179.104 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 4.0 ptpt -66.44 137.73 57.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.464 -179.473 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.9 p -85.06 -175.98 5.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.709 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.9 mmt85 -61.97 -30.46 70.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.809 0.337 . . . . 0.0 111.114 -179.811 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.84 9.04 10.73 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.839 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 66.77 38.46 3.82 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.292 0.568 . . . . 0.0 111.393 -178.739 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.463 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 13.9 mm100 -116.95 136.76 52.69 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 177.802 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -93.21 124.7 37.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.839 0.352 . . . . 0.0 111.549 -178.753 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.3 m -129.45 149.23 33.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.672 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.8 m -71.63 134.75 46.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.165 0.507 . . . . 0.0 111.523 -178.86 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.9 t -142.86 161.26 38.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.337 179.744 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -142.57 155.82 45.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.363 0.601 . . . . 0.0 111.848 -179.25 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.446 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.87 127.19 44.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.721 179.349 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -86.89 115.42 24.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.631 0.253 . . . . 0.0 110.946 -178.526 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.845 HD22 HD22 ' A' ' 69' ' ' LEU . 4.7 mp -85.87 -15.97 40.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.457 179.991 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.91 -47.28 74.58 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.366 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.405 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -92.05 -9.83 41.32 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 122.259 -0.275 . . . . 0.0 111.622 179.723 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.445 ' CE1' ' HB2' ' A' ' 100' ' ' TYR . 10.4 m80 -95.69 -67.02 0.87 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.535 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.503 HD13 ' CD1' ' A' ' 50' ' ' TRP . 12.9 mm -79.79 148.33 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.486 178.641 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.414 ' HB1' ' OG ' ' A' ' 53' ' ' SER . . . -141.03 171.75 13.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.511 -179.753 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.537 ' C ' HD12 ' A' ' 44' ' ' ILE . 21.0 t30 -113.16 112.8 24.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.144 -179.158 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.868 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.4 mp -113.25 88.96 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.952 0.406 . . . . 0.0 110.903 179.276 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 43.5 t0 70.89 38.16 1.2 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.075 179.924 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.72 0.36 89.19 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.161 179.464 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.4 m -110.57 135.71 50.8 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 117.107 0.454 . . . . 0.0 110.943 179.923 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.3 mt -77.61 118.45 20.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.635 0.731 . . . . 0.0 111.508 -178.114 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.868 ' HB2' HD13 ' A' ' 44' ' ' ILE . 28.4 mttt -137.41 162.75 32.8 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.102 -179.938 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.76 ' CE2' HG11 ' A' ' 90' ' ' VAL . 8.0 m-90 -85.95 119.39 26.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.921 0.391 . . . . 0.0 111.235 -179.648 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.428 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 14.6 tt0 -174.32 148.26 1.28 Allowed Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.344 -179.798 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 14.2 Cg_exo -66.43 70.28 0.45 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.374 2.049 . . . . 0.0 112.796 -179.061 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.414 ' OG ' ' HB1' ' A' ' 42' ' ' ALA . 3.0 p -162.73 133.67 4.87 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.006 179.026 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -81.19 107.19 13.78 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.991 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.461 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.6 p90 -47.62 -30.84 3.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.479 178.219 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.2 p -47.28 -17.87 0.09 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.874 -179.404 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.1 mm-40 -64.85 -30.75 71.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.648 0.261 . . . . 0.0 111.14 -179.339 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.501 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.7 p -125.86 4.54 7.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.428 179.716 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.5 m -116.84 148.18 41.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.286 0.565 . . . . 0.0 111.992 -178.898 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 43.0 p90 -142.82 157.88 44.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.796 -179.945 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.7 m-20 63.02 45.65 5.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.996 0.427 . . . . 0.0 110.421 -179.097 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.752 ' O ' HD22 ' A' ' 13' ' ' LEU . 62.9 m -69.96 136.31 50.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.371 179.803 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -140.77 151.23 44.27 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.719 -179.765 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.542 HG21 HD13 ' A' ' 19' ' ' LEU . 26.2 mt -130.32 139.7 50.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-O 121.287 0.565 . . . . 0.0 111.894 -179.901 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -139.36 111.01 7.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.051 178.901 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.15 -123.12 13.9 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.407 -0.901 . . . . 0.0 111.354 -178.644 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.423 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 22.9 p -102.3 -3.75 26.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.252 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.641 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.7 t -101.74 139.85 21.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.987 0.422 . . . . 0.0 111.627 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.845 HD22 HD22 ' A' ' 37' ' ' LEU . 6.4 tp -102.2 126.87 49.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.22 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.546 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.0 m -117.17 125.15 50.75 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.913 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.3 t -151.92 153.65 34.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.629 0.252 . . . . 0.0 111.422 -178.831 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 25.2 m -94.85 126.26 40.06 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.526 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 76.5 m -126.67 145.38 50.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.381 0.61 . . . . 0.0 112.577 -178.555 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -74.61 137.46 42.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.649 178.362 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -93.2 144.82 24.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.763 0.316 . . . . 0.0 110.553 179.63 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 m -52.21 -26.12 10.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.488 -179.44 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -82.89 0.24 45.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.387 179.9 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.06 136.78 7.45 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.833 179.779 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.33 -166.36 12.15 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 -178.68 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -132.3 142.82 49.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.198 0.499 . . . . 0.0 111.299 -179.453 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -153.97 128.8 9.45 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.104 -179.897 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -92.45 134.82 34.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.652 -179.255 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 60.2 p -122.03 157.99 30.14 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.357 179.755 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.5 m -122.44 145.86 47.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.754 0.312 . . . . 0.0 111.165 -179.804 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.693 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.7 tt -144.13 143.39 23.61 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.176 -179.526 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -96.41 113.35 24.92 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.7 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.564 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 12.9 mt -96.5 -5.47 39.36 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -178.878 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.796 ' OD1' HG22 ' A' ' 5' ' ' ILE . 53.0 t30 -44.71 -28.13 0.58 Allowed 'General case' 0 N--CA 1.467 0.417 0 O-C-N 122.111 -0.368 . . . . 0.0 111.936 -178.581 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 71.5 m -82.19 -39.37 23.25 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.896 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.76 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.4 m -72.89 -53.89 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -177.92 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.703 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.2 mp -82.57 147.73 5.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.935 0.397 . . . . 0.0 111.291 -179.066 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.428 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 6.7 tt0 -138.63 166.63 23.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.229 -178.839 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -107.08 99.77 9.3 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.13 0.49 . . . . 0.0 110.68 -179.769 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.445 HG21 ' CD ' ' A' ' 99' ' ' LYS . 39.2 t -98.33 96.83 5.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.035 179.421 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.8 t0 52.98 33.84 15.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.616 0.246 . . . . 0.0 111.535 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.2 28.6 12.91 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.414 179.397 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.6 t -141.24 135.28 30.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.822 0.344 . . . . 0.0 111.015 -179.961 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.428 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 67.9 mt -74.49 120.11 19.6 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.045 -179.787 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.476 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 10.7 mttm -122.47 139.13 54.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.932 -179.966 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.445 ' HB2' ' CE1' ' A' ' 40' ' ' HIS . 69.4 t80 -81.58 -29.46 33.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.579 -179.92 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.876 179.816 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.18 0 N-CA-C 112.556 -0.218 . . . . 0.0 112.556 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 6.9 mt -62.51 -46.05 90.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.914 0.388 . . . . 0.0 110.667 179.847 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -165.72 -72.61 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.203 179.982 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.1 mmtt 61.18 68.17 0.75 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.814 0.34 . . . . 0.0 110.857 179.847 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.42 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 18.0 p90 -92.21 -39.86 11.3 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.431 -179.889 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.807 HG22 ' OD1' ' A' ' 88' ' ' ASN . 7.0 tp -63.41 -19.95 25.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.737 0.303 . . . . 0.0 111.159 -179.834 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -73.96 -24.01 59.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.676 179.25 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 p -118.58 13.96 13.49 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.445 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 62.1 m -130.76 154.72 47.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.992 0.425 . . . . 0.0 111.066 -179.595 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.406 ' NH2' ' CZ ' ' A' ' 30' ' ' PHE . 15.0 ptp180 -132.99 172.73 12.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.04 -179.812 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.427 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.4 p-10 48.51 57.22 6.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.164 179.688 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.659 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.9 p -79.24 133.48 36.67 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.255 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.802 ' O ' HD12 ' A' ' 19' ' ' LEU . 1.3 pp0? -157.9 163.77 37.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.417 -179.013 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.778 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.43 135.12 39.76 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.949 -179.873 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.1 144.98 46.31 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 178.796 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.96 -153.24 30.68 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 119.726 -1.226 . . . . 0.0 111.504 -178.955 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.4 -36.57 19.07 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.351 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.82 35.67 1.78 Allowed 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.804 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 10.7 mp0 -115.95 148.91 39.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.092 0.472 . . . . 0.0 111.985 178.892 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.805 ' CB ' HD11 ' A' ' 37' ' ' LEU . 15.4 tp -123.79 124.61 43.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.173 179.012 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.26 143.27 46.7 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.68 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.36 172.63 16.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.463 -178.438 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -113.53 133.51 55.21 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 177.532 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 63.3 m -131.03 134.76 46.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.117 0.484 . . . . 0.0 111.962 -179.082 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -67.27 136.49 55.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.526 -179.613 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.42 HG22 ' HA3' ' A' ' 96' ' ' GLY . 65.4 p -86.29 -178.9 6.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.521 179.814 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -60.29 -29.22 68.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.785 0.326 . . . . 0.0 110.957 -179.712 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.75 8.53 9.81 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.798 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 66.66 38.13 4.1 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.324 0.583 . . . . 0.0 111.086 -178.692 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.427 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 9.9 mt-30 -119.8 135.57 54.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.039 178.376 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.406 ' CZ ' ' NH2' ' A' ' 9' ' ' ARG . 50.3 m-85 -92.77 124.73 36.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.963 0.411 . . . . 0.0 111.35 -178.981 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.4 m -128.64 151.02 34.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.91 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.4 p -70.95 133.01 46.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.168 0.509 . . . . 0.0 111.835 -178.555 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.2 t -143.4 161.42 38.42 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.323 179.871 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -143.77 155.28 44.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.231 0.539 . . . . 0.0 111.904 -178.936 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.736 HD11 ' HD1' ' A' ' 100' ' ' TYR . 1.1 tp -135.44 126.36 44.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.274 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -87.2 117.23 25.81 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.709 0.29 . . . . 0.0 111.136 -178.337 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.909 HD22 HD22 ' A' ' 69' ' ' LEU . 3.9 mp -87.74 -15.59 36.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.986 -179.623 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -58.24 -43.5 87.85 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.39 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 4.0 m-20 -91.97 -10.08 40.65 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.024 -0.423 . . . . 0.0 111.195 179.084 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.565 ' CE1' ' CD1' ' A' ' 100' ' ' TYR . 9.1 m80 -96.74 -63.06 1.17 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.633 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.624 HD11 HD22 ' A' ' 87' ' ' LEU . 24.1 mm -80.59 149.87 4.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.547 178.443 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.527 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.0 172.05 13.32 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.398 -179.773 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.652 HD22 ' HA2' ' A' ' 46' ' ' GLY . 24.1 t-20 -112.7 107.8 16.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.017 -179.021 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 48.0 mm -109.81 91.07 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.182 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.7 t70 66.25 39.58 4.1 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.005 -179.822 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.652 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 81.39 1.18 89.97 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.729 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 m -108.56 137.74 46.01 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.912 0.387 . . . . 0.0 111.253 -179.883 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.465 HD12 ' O ' ' A' ' 83' ' ' SER . 20.4 mt -77.19 115.82 17.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.592 0.711 . . . . 0.0 111.341 -178.151 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -137.71 162.83 32.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.201 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.756 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 5.8 m-90 -86.67 122.38 30.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.892 0.377 . . . . 0.0 111.717 -179.35 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.527 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 1.8 mt-30 -172.14 149.52 2.21 Favored Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.133 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.416 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 53.7 Cg_endo -71.66 64.85 3.07 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 121.932 1.754 . . . . 0.0 112.353 -179.811 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.61 134.09 9.74 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.174 179.02 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.422 ' N ' ' OD1' ' A' ' 54' ' ' ASN . 0.2 OUTLIER -81.04 110.13 16.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.509 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.435 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 47.9 p90 -49.25 -30.31 7.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.88 178.529 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.4 p -49.33 -18.15 0.34 Allowed 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -179.025 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -62.21 -28.07 69.43 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.889 -0.324 . . . . 0.0 111.17 -179.104 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.0 p -128.73 -1.89 5.38 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 179.703 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 72' ' ' THR . 5.8 m -108.72 149.43 29.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.125 0.488 . . . . 0.0 112.083 -178.594 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.2 p90 -141.52 157.26 45.35 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.301 179.903 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 64.14 47.68 3.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.84 -179.197 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.778 ' O ' HD22 ' A' ' 13' ' ' LEU . 55.8 m -70.1 135.38 49.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.788 179.73 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.29 152.32 42.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.714 -179.921 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.597 HG21 HD13 ' A' ' 19' ' ' LEU . 45.7 mt -130.96 140.33 48.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.253 0.549 . . . . 0.0 111.974 -179.724 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -136.26 109.77 7.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.274 179.208 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.47 -119.82 13.6 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.303 -0.951 . . . . 0.0 110.939 -178.457 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.413 ' HB3' ' HB ' ' A' ' 5' ' ' ILE . 24.8 p -102.34 -3.29 27.36 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.464 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.5 t -101.9 136.97 31.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.022 0.439 . . . . 0.0 111.811 179.975 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.909 HD22 HD22 ' A' ' 37' ' ' LEU . 5.3 tp -101.8 125.48 48.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.301 179.813 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.546 ' N ' HD12 ' A' ' 69' ' ' LEU . 16.7 m -115.46 126.36 54.23 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.5 t -151.77 153.54 34.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.792 0.33 . . . . 0.0 111.649 -178.933 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.6 m -95.42 126.02 40.43 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.812 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.549 ' HB3' HD22 ' A' ' 43' ' ' ASN . 74.9 m -126.19 144.5 50.74 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.598 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -74.31 137.64 43.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.375 178.037 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.2 mtm-85 -91.94 142.37 27.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.668 0.27 . . . . 0.0 110.593 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.2 m -52.21 -27.0 13.03 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.612 -179.361 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -83.05 1.98 37.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.706 0.289 . . . . 0.0 111.393 179.924 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.49 134.07 6.53 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.497 -179.873 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.11 -171.07 13.58 Favored Glycine 0 C--N 1.318 -0.459 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.625 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -132.19 144.19 50.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 117.28 0.54 . . . . 0.0 111.337 -179.905 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -154.39 132.29 11.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.245 179.879 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -94.45 134.44 36.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.306 -179.642 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.465 ' O ' HD12 ' A' ' 48' ' ' LEU . 38.3 p -120.61 158.28 27.72 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.283 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.07 144.33 48.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.26 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.756 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.4 tt -144.51 143.83 22.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.693 179.913 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -98.0 118.31 34.32 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.942 179.524 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.636 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 4.8 mt -100.32 -6.05 26.45 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -179.06 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.807 ' OD1' HG22 ' A' ' 5' ' ' ILE . 52.3 t30 -44.63 -28.25 0.58 Allowed 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -178.349 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 13.2 m -82.2 -39.53 22.99 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.659 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -72.32 -52.62 23.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 N-CA-C 113.445 0.905 . . . . 0.0 113.445 -177.943 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.515 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -81.55 147.3 6.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.131 0.491 . . . . 0.0 111.238 -179.17 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.45 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 15.3 tt0 -137.62 165.63 25.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.061 -178.617 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -107.63 100.16 9.58 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.235 0.54 . . . . 0.0 110.728 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.2 t -98.34 98.44 7.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.78 179.039 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.8 t0 54.17 32.55 16.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.672 0.272 . . . . 0.0 111.41 -179.801 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.42 ' HA3' HG22 ' A' ' 25' ' ' THR . . . 93.49 28.46 11.41 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.316 179.297 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.1 m -140.38 137.35 33.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.918 0.39 . . . . 0.0 111.571 -179.846 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.45 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 57.0 mt -74.38 119.04 18.04 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.686 179.873 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.434 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.5 mttm -126.57 145.35 50.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.671 -179.112 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.736 ' HD1' HD11 ' A' ' 35' ' ' ILE . 1.0 OUTLIER -91.55 138.42 31.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.023 179.406 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.232 -0.889 . . . . 0.0 111.003 -179.748 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.181 0 N-CA-C 112.55 -0.22 . . . . 0.0 112.55 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.498 HD23 ' N ' ' A' ' 1' ' ' LEU . 2.6 pt? -173.62 -39.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.694 0.283 . . . . 0.0 111.111 -179.938 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -58.46 153.12 28.74 Favored Glycine 0 CA--C 1.52 0.362 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.425 179.652 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -155.1 89.65 1.23 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.786 0.293 . . . . 0.0 111.255 179.915 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.417 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 13.2 p90 -98.42 -39.06 8.96 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.778 HG22 ' OD1' ' A' ' 88' ' ' ASN . 8.5 tp -62.64 -19.14 22.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.601 0.239 . . . . 0.0 111.544 -179.467 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -74.38 -25.64 59.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.615 0.245 . . . . 0.0 111.037 179.293 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.1 p -118.91 -0.94 11.09 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.641 179.287 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 80.6 m -109.84 151.42 27.03 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.898 0.38 . . . . 0.0 111.279 -179.706 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.1 172.24 12.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.015 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 48.88 58.76 4.98 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -179.871 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.749 HG21 ' CD1' ' A' ' 5' ' ' ILE . 12.6 p -79.25 134.07 36.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.84 178.622 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.69 ' O ' HD12 ' A' ' 19' ' ' LEU . 2.5 pt20 -157.26 163.65 38.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.507 -179.183 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.774 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.66 135.42 39.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.097 -179.869 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -118.61 144.17 46.31 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 178.657 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.81 -152.11 32.3 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 119.753 -1.213 . . . . 0.0 111.566 -179.01 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.99 -36.64 18.14 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.413 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.73 34.87 1.79 Allowed 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -178.588 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.8 OUTLIER -115.36 148.54 39.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.106 0.479 . . . . 0.0 112.06 178.788 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.817 ' CB ' HD11 ' A' ' 37' ' ' LEU . 12.6 tp -122.31 123.76 42.17 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.46 179.504 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.07 143.97 47.84 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.901 0.381 . . . . 0.0 110.031 179.405 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.6 172.56 16.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.876 -178.539 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -112.56 133.57 54.55 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 176.893 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 58.4 m -130.59 133.57 46.29 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.51 -0.476 . . . . 0.0 112.026 -178.924 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 3.7 ptpt -66.03 136.95 56.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.664 -179.78 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.496 HG22 ' O ' ' A' ' 95' ' ' ASP . 63.7 p -85.98 -176.92 6.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.566 179.872 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -61.52 -29.72 70.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.674 0.273 . . . . 0.0 111.183 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.0 8.39 10.71 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.622 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 66.26 38.08 4.69 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.216 0.531 . . . . 0.0 111.196 -178.725 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.412 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 32.9 mt-30 -118.58 135.83 54.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.664 178.307 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -92.88 124.53 36.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.061 0.458 . . . . 0.0 111.786 -178.518 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.7 m -130.3 151.29 35.65 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.723 -179.983 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.4 t -72.44 136.46 46.01 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.166 0.508 . . . . 0.0 112.079 -178.723 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 t -145.13 161.72 38.8 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.265 179.884 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt -143.1 157.19 44.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.48 0.657 . . . . 0.0 112.177 -179.215 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.467 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.7 OUTLIER -136.74 125.6 36.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.922 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -88.32 119.56 28.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.621 0.248 . . . . 0.0 110.977 -177.93 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 69' ' ' LEU . 3.9 mp -88.94 -14.88 35.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.488 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.2 p-10 -57.4 -45.61 84.35 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.222 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.436 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 3.8 p30 -92.83 -10.48 36.64 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.906 -0.496 . . . . 0.0 111.377 178.567 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.47 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 9.5 m-70 -94.29 -66.07 0.94 Allowed 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.959 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.622 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.6 mp -81.24 150.64 4.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.938 178.809 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.542 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.98 171.68 13.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.808 -179.032 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.541 ' C ' HD12 ' A' ' 44' ' ' ILE . 27.3 t-20 -113.25 111.52 22.18 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.367 -179.202 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.79 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.4 mp -112.45 89.32 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-O 120.918 0.389 . . . . 0.0 111.161 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t0 67.32 38.13 3.37 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.937 179.369 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.467 ' HA2' HD22 ' A' ' 43' ' ' ASN . . . 85.54 0.85 87.98 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.473 -0.87 . . . . 0.0 113.158 179.307 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.1 m -112.94 136.48 52.56 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.193 0.496 . . . . 0.0 110.842 179.776 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.9 mt -77.38 117.97 19.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.649 0.738 . . . . 0.0 112.541 -177.521 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.79 ' HB2' HD13 ' A' ' 44' ' ' ILE . 40.6 mttt -139.61 163.01 33.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.545 179.475 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.766 ' CH2' HD11 ' A' ' 85' ' ' ILE . 9.5 m-90 -87.7 127.08 35.3 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.892 0.331 . . . . 0.0 111.892 -179.4 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.542 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.1 OUTLIER -172.92 159.14 3.57 Favored Pre-proline 0 N--CA 1.468 0.432 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.686 -179.785 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -77.02 61.55 7.21 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 122.118 1.879 . . . . 0.0 112.142 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.1 p -156.47 135.34 11.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.85 -1.068 . . . . 0.0 108.599 179.193 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.29 109.87 16.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.227 0.536 . . . . 0.0 112.139 -178.182 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -46.41 -30.02 1.96 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.087 178.764 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.6 p -50.65 -17.11 0.47 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -179.049 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -61.2 -29.37 69.77 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.838 -179.308 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.3 p -129.68 0.63 4.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.531 179.249 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.9 m -110.86 148.3 32.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.3 0.572 . . . . 0.0 112.06 -178.581 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -141.72 157.53 44.94 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.021 -179.682 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.8 m120 63.71 45.62 4.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.912 0.387 . . . . 0.0 110.879 -179.356 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.774 ' O ' HD22 ' A' ' 13' ' ' LEU . 58.1 m -69.01 137.2 53.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.513 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.408 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -143.58 152.13 41.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.071 -179.433 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.507 HG21 HD13 ' A' ' 19' ' ' LEU . 39.9 mt -131.01 140.27 49.05 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 121.302 0.573 . . . . 0.0 112.239 -179.898 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -137.88 110.68 7.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.273 179.271 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.66 -121.71 17.95 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.368 -0.92 . . . . 0.0 111.171 -178.602 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.414 ' HB3' HG21 ' A' ' 5' ' ' ILE . 21.1 p -100.49 -2.92 31.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.984 0.392 . . . . 0.0 112.002 -179.408 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.579 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.4 t -103.57 138.41 28.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -179.633 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 37' ' ' LEU . 6.7 tp -102.85 124.64 48.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.615 179.606 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.466 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.7 m -115.52 126.65 54.54 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -179.948 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.2 t -151.89 153.8 34.87 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.128 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 8.3 m -95.06 126.42 40.39 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 178.814 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.532 ' HB3' HD22 ' A' ' 43' ' ' ASN . 73.4 m -127.32 146.3 50.49 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -178.266 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -75.82 137.29 40.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.631 178.042 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 47.8 mtm-85 -92.06 146.04 24.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.743 0.306 . . . . 0.0 110.601 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.1 m -51.92 -31.41 28.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.851 -179.169 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -81.74 2.82 28.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.619 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.19 136.27 6.83 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.34 -179.82 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.0 -173.46 14.71 Favored Glycine 0 C--N 1.317 -0.498 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 -178.41 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -131.65 143.24 50.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.398 0.599 . . . . 0.0 111.484 -179.798 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -154.44 130.81 10.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.38 179.563 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 0.9 OUTLIER -92.46 134.28 35.1 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.157 -179.763 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.6 p -119.72 158.65 26.06 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.383 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.47 144.66 48.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.338 -179.52 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.766 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.8 tt -146.97 145.01 19.71 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.577 179.728 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -98.25 118.7 35.47 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.648 179.502 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.533 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 7.0 mt -99.72 -6.46 27.07 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -178.738 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.778 ' OD1' HG22 ' A' ' 5' ' ' ILE . 39.0 t30 -45.06 -28.61 0.73 Allowed 'General case' 0 N--CA 1.468 0.442 0 O-C-N 122.17 -0.331 . . . . 0.0 111.825 -178.532 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 7.5 m -80.35 -39.61 28.22 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.705 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.0 m -73.5 -52.58 20.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -178.367 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.614 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.1 mp -81.75 147.32 6.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.927 0.394 . . . . 0.0 111.235 -179.174 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -137.16 165.42 26.14 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.179 -178.709 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -106.4 99.83 9.39 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.133 0.492 . . . . 0.0 110.708 -179.651 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.7 t -99.26 96.75 5.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.171 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.496 ' O ' HG22 ' A' ' 25' ' ' THR . 15.8 t0 52.7 33.37 13.74 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 179.742 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.23 28.43 11.72 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.748 -0.739 . . . . 0.0 113.206 179.235 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.0 t -141.63 134.31 28.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.779 0.323 . . . . 0.0 111.174 -179.831 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.409 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 73.8 mt -74.75 120.34 20.16 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.054 0.454 . . . . 0.0 110.88 179.923 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -123.3 138.97 54.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.281 -179.71 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.47 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 36.2 t80 -83.38 85.77 7.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.476 179.518 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.309 -0.853 . . . . 0.0 110.833 -179.899 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.16 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.9 tt 61.58 97.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.808 0.337 . . . . 0.0 110.781 -179.93 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 92.14 -114.77 4.64 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.321 -179.781 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.9 mttt 59.65 65.54 1.13 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.986 0.422 . . . . 0.0 110.786 179.997 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.464 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 22.7 p90 -89.88 -39.18 13.21 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.289 179.968 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.805 HG22 ' OD1' ' A' ' 88' ' ' ASN . 6.4 tp -64.46 -16.32 19.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.714 0.292 . . . . 0.0 111.397 -179.871 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -76.04 -24.95 55.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.817 0.342 . . . . 0.0 110.802 179.36 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.4 p -118.29 -4.04 10.96 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.656 179.775 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 60.4 m -109.69 153.64 23.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.161 0.505 . . . . 0.0 111.067 -179.557 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 22.2 ptt180 -132.27 173.03 11.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.615 -179.948 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.402 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.9 p-10 49.12 58.01 5.85 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.011 0.434 . . . . 0.0 112.027 179.867 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.616 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.1 p -79.31 130.02 35.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.952 178.801 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.708 ' O ' HD12 ' A' ' 19' ' ' LEU . 1.8 pt20 -156.15 163.15 39.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.38 -179.403 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.72 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.64 136.57 37.82 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.467 179.901 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -121.03 144.6 48.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.071 179.273 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.21 -152.09 29.86 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 119.85 -1.167 . . . . 0.0 111.36 -178.759 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.16 -37.07 19.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.098 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.34 36.59 1.69 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.92 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 3.2 mp0 -115.71 145.74 42.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.15 0.5 . . . . 0.0 111.512 178.922 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.806 ' CB ' HD11 ' A' ' 37' ' ' LEU . 13.3 tp -119.92 123.79 44.42 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 178.913 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.29 142.89 46.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.876 0.369 . . . . 0.0 110.041 179.595 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.22 172.28 16.96 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.001 -178.795 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -114.39 133.55 55.63 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.69 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.407 ' SG ' HD21 ' A' ' 98' ' ' LEU . 39.4 m -130.61 133.38 46.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.134 0.492 . . . . 0.0 111.709 -179.12 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 3.1 ptpt -66.59 137.99 57.15 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.451 -179.624 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 21.1 p -85.48 -177.13 6.36 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.637 179.862 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.4 mtt-85 -61.33 -30.35 70.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.298 -179.673 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.77 9.46 9.7 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -179.099 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 66.84 38.34 3.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.223 0.535 . . . . 0.0 111.609 -178.838 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.503 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 16.0 mm100 -116.8 137.68 52.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.811 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -94.65 124.77 38.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.896 0.379 . . . . 0.0 111.883 -178.778 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 23.5 m -130.47 151.47 35.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.914 179.543 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.3 m -72.45 134.87 45.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.223 0.535 . . . . 0.0 111.617 -178.842 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.2 t -141.75 161.51 37.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.002 179.713 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -140.74 154.14 46.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.462 0.649 . . . . 0.0 112.007 -178.895 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.477 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -138.36 122.58 21.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.0 -1.0 . . . . 0.0 108.61 179.214 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -86.57 119.14 26.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.824 0.345 . . . . 0.0 110.863 -178.646 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.848 HD22 HD22 ' A' ' 69' ' ' LEU . 4.4 mp -87.0 -15.56 38.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.757 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.447 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -57.49 -45.92 84.31 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.024 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.447 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.3 m-20 -92.13 -10.04 40.33 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 122.101 -0.375 . . . . 0.0 111.53 179.599 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 16.1 m80 -98.63 -67.45 0.85 Allowed 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.799 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.561 HD12 ' N ' ' A' ' 41' ' ' ILE . 3.3 mp -81.13 149.71 4.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.407 178.783 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.474 ' HB3' ' CG ' ' A' ' 51' ' ' GLN . . . -141.4 172.57 12.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.148 -179.37 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.482 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 12.9 t30 -112.45 114.68 27.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.98 179.682 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.703 HD11 ' OE1' ' A' ' 51' ' ' GLN . 49.7 mm -113.41 89.35 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.384 -179.641 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 56.8 t0 71.12 38.53 1.08 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.95 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.41 0.68 88.25 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.889 179.779 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.9 m -115.2 136.29 53.26 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.917 0.389 . . . . 0.0 110.814 179.793 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.6 mt -77.5 120.26 22.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.516 0.674 . . . . 0.0 111.545 -178.16 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -135.37 162.06 33.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.873 179.877 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.769 ' CE2' HG11 ' A' ' 90' ' ' VAL . 8.0 m-90 -89.2 117.61 28.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.061 0.458 . . . . 0.0 112.193 -179.065 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.703 ' OE1' HD11 ' A' ' 44' ' ' ILE . 3.0 pt20 -178.55 151.12 0.72 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.974 178.656 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.415 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 28.4 Cg_endo -63.21 81.98 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.263 1.975 . . . . 0.0 113.118 -178.697 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.414 ' OG ' ' CB ' ' A' ' 42' ' ' ALA . 3.0 p -172.38 131.92 0.61 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.018 178.938 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.81 108.87 15.69 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -177.921 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 25.1 p90 -47.91 -29.77 3.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.469 178.544 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.7 p -48.8 -15.92 0.11 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.217 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -64.63 -30.79 71.82 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.599 -178.79 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.482 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -129.75 2.81 4.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.504 0.192 . . . . 0.0 111.301 179.763 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.6 m -112.2 148.03 34.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.207 0.527 . . . . 0.0 111.827 -179.013 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -142.48 157.37 44.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.017 -179.724 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 63.33 47.61 3.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.961 0.41 . . . . 0.0 110.693 -179.187 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.72 ' O ' HD22 ' A' ' 13' ' ' LEU . 21.1 m -70.11 136.36 50.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.598 179.865 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.513 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.04 152.09 43.04 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.494 179.791 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.499 HG21 HD13 ' A' ' 19' ' ' LEU . 34.6 mt -130.28 140.6 48.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.219 0.533 . . . . 0.0 111.649 -179.933 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -137.44 110.6 7.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.236 -0.893 . . . . 0.0 108.99 179.059 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.68 -122.33 16.9 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.24 -0.981 . . . . 0.0 111.179 -178.651 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.427 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 20.8 p -101.18 -4.33 27.43 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -179.521 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.509 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.5 t -101.74 139.56 22.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.969 0.414 . . . . 0.0 111.691 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.848 HD22 HD22 ' A' ' 37' ' ' LEU . 8.0 tp -102.22 127.82 49.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.356 179.834 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.524 ' N ' HD12 ' A' ' 69' ' ' LEU . 6.8 m -117.24 124.34 48.82 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.6 t -151.26 153.32 34.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.686 -0.233 . . . . 0.0 111.159 -178.881 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.9 m -93.14 125.96 38.0 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.015 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.3 m -127.14 144.34 51.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.316 0.579 . . . . 0.0 112.52 -178.774 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -74.84 138.1 42.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.857 178.454 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 59.5 mtp180 -92.65 143.55 26.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.66 0.267 . . . . 0.0 110.53 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.2 m -51.83 -25.63 8.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.565 -0.288 . . . . 0.0 111.448 -179.429 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -82.79 0.84 41.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.762 0.315 . . . . 0.0 111.442 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.36 135.86 6.73 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.437 -179.935 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.55 -168.49 12.76 Favored Glycine 0 C--N 1.319 -0.386 0 N-CA-C 111.298 -0.721 . . . . 0.0 111.298 -178.742 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -131.19 141.63 50.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 117.145 0.473 . . . . 0.0 111.246 -179.626 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -154.28 130.71 10.54 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.26 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -93.35 134.37 35.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.303 -179.478 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 p -120.9 158.47 27.59 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.902 0.382 . . . . 0.0 110.542 179.911 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 60.5 p -120.6 143.74 48.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.751 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 14.4 tt -144.51 142.07 23.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.382 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -96.31 116.6 29.28 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.213 179.876 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.662 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 10.0 mt -96.64 -6.64 36.18 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -179.025 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.805 ' OD1' HG22 ' A' ' 5' ' ' ILE . 55.8 t30 -44.99 -29.48 0.84 Allowed 'General case' 0 N--CA 1.466 0.355 0 O-C-N 122.186 -0.322 . . . . 0.0 111.705 -178.652 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.75 -41.0 24.24 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.947 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.769 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -71.01 -53.19 22.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 113.358 0.874 . . . . 0.0 113.358 -177.91 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.57 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.81 147.79 5.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.992 0.425 . . . . 0.0 111.568 -178.836 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.412 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 13.4 tt0 -137.02 165.66 25.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.866 -179.074 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -107.57 99.71 9.19 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.112 0.482 . . . . 0.0 110.25 179.837 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.401 HG23 ' HB2' ' A' ' 99' ' ' LYS . 38.9 t -98.81 96.69 5.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.136 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.8 t0 52.75 33.99 15.23 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.716 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.5 28.07 12.05 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.845 -0.693 . . . . 0.0 113.389 179.155 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.1 t -141.89 135.46 29.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.789 0.328 . . . . 0.0 111.401 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.412 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 64.3 mt -73.59 119.26 17.57 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.425 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.405 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.0 mttm -125.29 148.63 48.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.647 -178.995 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -95.19 81.28 3.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.902 -179.841 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.961 179.985 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 112.519 -0.233 . . . . 0.0 112.519 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 12.8 tp 64.83 140.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.828 0.347 . . . . 0.0 111.111 179.988 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 104.17 -107.76 3.02 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.019 -179.77 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 63.54 68.58 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.834 0.349 . . . . 0.0 111.336 179.36 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.407 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 15.8 p90 -92.49 -37.89 12.26 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.194 179.584 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.801 ' CD1' HG21 ' A' ' 11' ' ' THR . 3.9 tp -66.06 -13.64 16.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.727 0.299 . . . . 0.0 111.101 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -77.34 -27.36 52.74 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.016 0.436 . . . . 0.0 109.874 178.932 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 42.6 p -118.74 11.22 12.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.138 178.755 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.7 m -124.94 149.88 47.18 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.153 0.501 . . . . 0.0 111.616 -179.043 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -133.64 173.0 11.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.797 179.764 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 p30 49.99 56.91 7.16 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.792 0.437 . . . . 0.0 112.07 -179.743 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.801 HG21 ' CD1' ' A' ' 5' ' ' ILE . 25.0 p -79.27 133.8 36.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.898 178.588 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.688 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.9 pt20 -157.09 163.68 38.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.571 -179.166 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.761 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.7 136.08 38.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.905 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.92 144.31 48.51 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.1 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.67 -152.92 34.07 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 119.866 -1.159 . . . . 0.0 111.281 -178.859 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.57 -37.05 20.02 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.43 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -142.09 35.61 1.54 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -179.085 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 2.1 mp0 -113.28 147.27 37.91 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.959 0.409 . . . . 0.0 111.511 178.604 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.807 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.9 tp -119.65 124.79 47.14 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.983 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.01 143.32 49.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.531 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.65 172.64 15.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.187 -178.795 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -111.2 133.85 53.23 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.044 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.3 m -130.82 133.98 46.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.124 0.488 . . . . 0.0 111.881 -179.089 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 8.3 ptpt -66.03 136.79 56.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.382 -179.606 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.8 p -85.45 -176.29 6.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.52 179.85 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 39.4 mtm180 -61.54 -30.68 70.8 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.642 0.258 . . . . 0.0 111.316 -179.615 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.86 9.89 10.97 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.097 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 66.57 39.45 3.75 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.263 0.554 . . . . 0.0 111.614 -178.795 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.434 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 50.0 mt-30 -117.12 136.44 53.0 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.565 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -92.56 124.33 36.51 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.614 -178.688 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.6 m -128.89 149.08 33.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.354 179.448 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.7 m -72.36 136.7 46.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.269 0.557 . . . . 0.0 111.616 -178.847 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -142.17 161.21 38.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.148 179.668 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.9 154.22 47.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.394 0.616 . . . . 0.0 112.012 -179.379 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.512 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -136.89 126.43 37.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.096 -0.957 . . . . 0.0 108.858 179.656 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -87.94 115.52 25.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.609 0.243 . . . . 0.0 111.622 -178.032 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.912 HD22 HD22 ' A' ' 69' ' ' LEU . 3.8 mp -87.03 -16.33 35.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.22 179.359 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.66 -45.13 81.86 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.691 0.281 . . . . 0.0 111.399 -178.863 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.409 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -92.05 -10.49 38.95 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 122.241 -0.287 . . . . 0.0 111.617 179.633 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.487 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 17.7 m-70 -97.43 -64.47 1.04 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.503 HD11 HD22 ' A' ' 87' ' ' LEU . 29.8 mm -79.77 148.05 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.645 179.026 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -140.01 172.04 13.33 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.603 -179.775 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.54 ' C ' HD12 ' A' ' 44' ' ' ILE . 32.9 t30 -113.02 111.23 21.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.378 -178.939 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.763 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.2 mp -111.21 89.49 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.915 179.289 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.1 t70 67.95 38.14 2.87 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.105 -179.958 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.71 2.39 88.71 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.627 -0.797 . . . . 0.0 113.231 179.448 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.2 m -111.5 136.32 50.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.201 0.501 . . . . 0.0 111.162 -179.946 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.1 mt -77.5 117.47 18.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.616 0.722 . . . . 0.0 111.384 -178.199 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.763 ' HB2' HD13 ' A' ' 44' ' ' ILE . 8.9 mttm -138.45 163.01 33.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.128 -179.841 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 50' ' ' TRP . . . . . 0.726 ' CE2' HG11 ' A' ' 90' ' ' VAL . 7.3 m-90 -85.91 119.82 26.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.991 0.424 . . . . 0.0 111.493 -179.464 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.454 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 40.5 tt0 -174.99 143.52 0.77 Allowed Pre-proline 0 N--CA 1.463 0.221 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.359 -179.983 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.454 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 29.6 Cg_endo -64.68 72.09 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 122.289 1.993 . . . . 0.0 112.868 -179.171 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.9 p -163.44 133.8 4.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.4 178.932 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.47 ' N ' ' OD1' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.41 109.88 15.33 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.682 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 12.7 p90 -50.09 -30.47 11.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.721 178.522 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.421 ' N ' ' CD1' ' A' ' 55' ' ' PHE . 77.3 p -48.4 -19.63 0.33 Allowed 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -179.196 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -60.49 -26.29 66.71 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.944 -0.302 . . . . 0.0 111.073 -179.096 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.449 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -132.08 0.29 3.8 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.501 179.204 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 59' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.3 m -110.95 148.35 32.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.159 0.504 . . . . 0.0 111.912 -178.75 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -143.47 157.79 44.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.081 -179.739 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 64.6 45.46 3.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.922 0.391 . . . . 0.0 110.884 -179.41 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.761 ' O ' HD22 ' A' ' 13' ' ' LEU . 68.1 m -69.54 136.29 51.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.777 179.893 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.24 150.51 42.73 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.318 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.476 ' CG1' HD13 ' A' ' 69' ' ' LEU . 35.2 mt -129.13 138.98 53.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.301 0.572 . . . . 0.0 111.631 179.93 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -136.27 110.22 8.22 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.374 179.265 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.85 -121.09 13.58 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.403 -0.903 . . . . 0.0 110.982 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.408 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 26.9 p -101.85 -5.7 24.47 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -179.259 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.556 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.5 t -101.03 141.28 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.075 0.465 . . . . 0.0 111.773 179.693 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.912 HD22 HD22 ' A' ' 37' ' ' LEU . 5.4 tp -103.96 126.63 51.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.565 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.586 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.5 m -116.05 125.88 53.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.325 -179.956 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.3 t -151.7 153.83 35.14 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.625 0.25 . . . . 0.0 111.336 -179.294 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.2 m -94.08 125.95 39.02 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.651 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 93.0 m -124.53 142.89 51.0 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -178.41 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -73.14 137.06 44.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.657 178.42 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -92.29 142.42 27.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.632 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 m -52.05 -29.23 20.37 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.476 -179.499 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -82.45 1.27 38.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.45 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.35 135.81 7.61 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.99 179.646 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.07 -169.89 13.14 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -131.27 142.66 50.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.32 0.56 . . . . 0.0 111.142 -179.899 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -153.84 128.18 9.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.029 -179.697 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 5.2 t -92.64 134.96 34.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.685 -179.028 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 64.1 p -121.33 158.38 28.35 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.375 179.954 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.0 m -122.83 144.81 48.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.976 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.686 HD11 ' CH2' ' A' ' 50' ' ' TRP . 12.0 tt -144.91 142.83 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.815 -179.818 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -95.3 115.46 27.46 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.93 179.597 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.579 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 14.9 mt -97.01 -5.29 38.06 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -179.343 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.8 ' OD1' HG22 ' A' ' 5' ' ' ILE . 53.7 t30 -44.42 -28.95 0.62 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.447 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 64.5 m -82.23 -38.07 25.05 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.749 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 90' ' ' VAL . . . . . 0.726 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -74.09 -52.96 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -177.996 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.589 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.59 146.41 7.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.032 0.444 . . . . 0.0 111.292 -179.161 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 22.1 tt0 -137.38 167.07 22.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.077 -178.851 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -107.18 99.43 8.97 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.131 0.491 . . . . 0.0 110.501 -179.745 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.5 t -97.77 95.88 4.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.826 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.9 t0 54.16 33.8 18.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.659 0.266 . . . . 0.0 111.549 179.939 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.37 28.55 12.76 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.97 179.631 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.5 t -139.82 134.25 31.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.85 0.357 . . . . 0.0 111.187 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.414 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 71.8 mt -73.51 120.09 18.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.57 179.951 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 99' ' ' LYS . . . . . 0.409 ' O ' ' N ' ' A' ' 92' ' ' GLU . 18.8 mttt -124.93 130.95 53.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.565 -178.927 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 100' ' ' TYR . . . . . 0.487 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 26.3 t80 -79.81 -33.6 40.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.365 179.636 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.274 -0.869 . . . . 0.0 110.79 179.756 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 33.5 p90 . . . . . 0 N--CA 1.462 0.159 0 CA-C-O 120.912 0.387 . . . . 0.26 110.661 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.974 HG22 ' ND2' ' A' ' 88' ' ' ASN . 2.2 tp -63.03 -19.42 23.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 0.21 111.569 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -75.65 -27.25 58.3 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.904 -0.318 . . . . 2.01 111.151 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 50.6 p -118.78 14.11 13.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.519 -0.31 . . . . 0.33 111.501 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.2 m -129.67 151.32 50.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.067 0.461 . . . . 0.17 111.353 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.62 172.83 12.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.715 -0.675 . . . . 2.56 110.723 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.44 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 4.9 p-10 49.16 56.05 8.38 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.211 -0.45 . . . . 1.24 111.875 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.1 p -79.19 134.1 36.69 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.733 -0.469 . . . . 0.34 109.733 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.757 ' O ' HD12 ' A' ' 19' ' ' LEU . 15.3 pt20 -157.26 163.41 38.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.125 -0.489 . . . . 1.35 111.511 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.68 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.35 136.56 37.65 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.713 -0.676 . . . . 0.09 110.958 -179.664 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.58 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.1 146.29 46.08 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.319 -0.855 . . . . 0.1 109.324 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.21 -152.64 24.5 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.002 -1.094 . . . . 0.11 111.438 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.52 -36.41 18.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.014 0.407 . . . . 0.13 111.352 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.538 ' OG ' ' HB3' ' A' ' 38' ' ' ASP . 8.0 p -144.71 72.17 1.33 Allowed 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.509 -0.923 . . . . 0.16 108.509 179.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.58 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 4.5 mp0 -146.13 141.19 27.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.538 -0.756 . . . . 1.13 111.508 176.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.757 HD12 ' O ' ' A' ' 12' ' ' GLN . 21.2 tp -121.45 120.98 36.52 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.102 -0.703 . . . . 0.12 109.102 177.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.42 144.33 45.1 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.712 -0.477 . . . . 0.09 109.712 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.56 172.51 16.24 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.061 -0.518 . . . . 0.1 110.729 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -112.83 133.25 54.91 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.163 -1.051 . . . . 1.58 108.163 176.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 59.0 m -131.0 136.39 48.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.228 0.537 . . . . 0.14 112.025 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 5.4 ptpt -68.03 135.22 51.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.465 -0.789 . . . . 0.79 111.632 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.7 p -87.03 -175.43 5.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.246 -0.888 . . . . 0.17 110.617 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -59.16 -33.73 71.26 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.604 0.594 . . . . 2.98 112.604 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.45 11.67 8.2 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.554 0.576 . . . . 0.17 112.554 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 67.09 41.86 2.51 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.589 0.709 . . . . 1.83 110.497 -178.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.479 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 11.5 mt-30 -116.68 132.63 56.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.692 -1.14 . . . . 1.92 108.513 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.408 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 77.4 m-85 -90.66 124.21 34.89 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.495 -0.482 . . . . 0.97 110.727 -179.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.7 m -122.29 160.89 23.89 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-O 120.974 0.416 . . . . 0.16 111.584 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.46 126.5 31.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.844 -0.616 . . . . 1.28 111.151 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.5 t -140.42 157.46 45.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.327 -0.397 . . . . 0.13 110.779 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -145.9 142.35 28.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.236 0.541 . . . . 1.6 112.106 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.445 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.9 tp -118.57 126.62 75.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.367 -0.833 . . . . 0.11 108.77 178.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -87.3 118.64 26.87 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 122.271 -0.268 . . . . 0.95 110.672 -178.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.723 HD22 HD22 ' A' ' 69' ' ' LEU . 4.7 mp -87.56 -16.05 35.71 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.353 0.501 . . . . 0.11 112.353 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.538 ' HB3' ' OG ' ' A' ' 17' ' ' SER . 23.3 p30 -56.07 -45.38 79.33 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.582 0.586 . . . . 1.89 112.582 -177.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.533 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 2.5 p30 -91.37 -10.25 41.87 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 122.261 -0.274 . . . . 1.66 111.699 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -97.32 -64.21 1.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.747 -0.464 . . . . 0.24 109.747 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.487 HG13 HD23 ' A' ' 37' ' ' LEU . 25.6 mm -81.01 151.27 4.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.85 -0.614 . . . . 1.0 111.358 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.507 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.15 172.18 13.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.495 -0.775 . . . . 0.15 111.327 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.67 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 23.1 t30 -111.34 110.91 21.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.943 -0.571 . . . . 0.15 110.614 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.6 mm -110.39 92.34 2.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.947 -0.569 . . . . 1.0 112.004 -179.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 20.4 t0 62.65 37.18 13.06 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.777 0.323 . . . . 1.13 111.252 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.26 0.79 88.5 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.612 -0.804 . . . . 0.14 112.942 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.5 m -113.18 135.5 53.75 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.982 0.391 . . . . 0.2 110.649 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.401 HD12 ' OG ' ' A' ' 83' ' ' SER . 21.2 mt -77.04 118.72 19.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.604 0.716 . . . . 0.2 110.95 -178.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -137.15 162.51 33.23 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 114.654 -1.157 . . . . 1.33 110.042 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.798 ' CH2' HD11 ' A' ' 85' ' ' ILE . 9.7 m-90 -85.54 119.15 25.57 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.999 0.428 . . . . 0.26 111.466 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.507 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 13.1 tt0 -174.9 141.22 0.69 Allowed Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.829 -0.623 . . . . 1.79 110.131 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -66.07 70.18 0.4 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.195 1.93 . . . . 0.4 112.979 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.46 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.0 p -155.08 137.32 14.83 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.831 -1.077 . . . . 0.26 108.154 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.406 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.5 OUTLIER -80.95 104.2 11.3 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.097 0.777 . . . . 0.81 113.097 -176.806 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.528 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 44.2 p90 -51.9 -36.59 49.35 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.195 -0.911 . . . . 0.52 110.108 177.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 77.5 p -45.82 -25.1 0.46 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 114.938 -1.028 . . . . 0.27 112.939 -178.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -66.27 -20.24 66.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.676 0.275 . . . . 1.73 111.352 -179.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.67 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 30.1 p -128.69 6.71 5.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.485 -0.325 . . . . 0.17 111.007 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.2 m -126.45 149.67 49.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.209 0.528 . . . . 0.1 111.703 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.3 p90 -142.42 157.86 44.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.319 -0.855 . . . . 0.96 109.817 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 54.1 m-20 63.38 46.65 4.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.096 0.474 . . . . 0.95 110.639 -179.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.68 ' O ' HD22 ' A' ' 13' ' ' LEU . 46.1 m -69.37 135.11 49.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.847 -0.615 . . . . 0.15 110.178 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.431 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -141.96 150.04 40.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.493 . . . . 0.11 111.703 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.542 HG13 ' HB2' ' A' ' 13' ' ' LEU . 38.6 mt -130.45 142.44 43.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.222 0.534 . . . . 0.11 111.86 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -139.64 111.93 7.64 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.253 -0.885 . . . . 1.7 108.847 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.571 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 66.75 -122.97 21.32 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.242 -0.98 . . . . 0.12 111.58 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.602 ' N ' HD13 ' A' ' 5' ' ' ILE . 82.5 p -100.36 -5.64 26.99 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.492 0.553 . . . . 0.15 112.492 -178.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.479 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.6 t -102.8 139.87 22.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 121.052 0.453 . . . . 0.14 111.692 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.723 HD22 HD22 ' A' ' 37' ' ' LEU . 7.1 tp -102.25 126.95 49.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.824 -0.625 . . . . 0.12 110.89 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.51 ' N ' HD12 ' A' ' 69' ' ' LEU . 4.5 m -116.04 123.99 49.32 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.962 -0.385 . . . . 0.14 109.962 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.425 ' O ' ' HA ' ' A' ' 82' ' ' THR . 11.2 t -151.54 153.38 34.43 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.253 -0.179 . . . . 0.12 111.245 -178.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.57 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 15.6 m -95.72 126.47 41.01 Favored 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 109.832 -0.433 . . . . 0.15 109.832 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.427 ' HB3' ' OD1' ' A' ' 43' ' ' ASN . 72.3 m -126.87 145.85 50.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.361 0.6 . . . . 0.1 112.17 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -74.96 139.08 42.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.167 -0.924 . . . . 1.26 111.113 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -91.32 145.0 25.01 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.915 -0.402 . . . . 3.35 109.915 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 34.9 m -51.46 -32.1 25.74 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.466 0.543 . . . . 0.26 112.466 -178.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -83.58 4.6 27.52 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.04 0.385 . . . . 1.71 112.04 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.15 136.94 8.02 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.668 -0.777 . . . . 0.16 113.106 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 119.55 -174.58 15.52 Favored Glycine 0 N--CA 1.451 -0.337 0 N-CA-C 110.94 -0.864 . . . . 0.16 110.94 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -130.63 140.88 50.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.383 0.592 . . . . 0.75 111.032 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -154.16 131.04 10.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.139 -0.482 . . . . 1.16 110.421 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.57 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.3 t -93.71 134.67 35.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.15 111.118 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.401 ' OG ' HD12 ' A' ' 48' ' ' LEU . 53.1 p -120.19 158.03 27.83 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.191 -0.459 . . . . 0.32 110.446 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.49 144.48 49.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.977 0.418 . . . . 1.07 111.045 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.798 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.0 tt -145.79 143.16 21.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.939 -0.573 . . . . 0.73 111.448 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -98.88 120.14 38.83 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.383 -0.371 . . . . 1.18 110.935 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.667 ' HB3' HD12 ' A' ' 91' ' ' ILE . 11.4 mt -100.28 -3.59 31.06 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.51 0.93 . . . . 0.19 113.51 -178.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.974 ' ND2' HG22 ' A' ' 5' ' ' ILE . 11.3 t-20 -44.69 -28.97 0.68 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.038 0.381 . . . . 0.24 111.755 -178.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 37.1 m -84.02 -39.3 19.81 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.575 0.583 . . . . 1.07 112.575 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.78 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.0 m -73.24 -49.22 39.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.946 0.721 . . . . 0.2 112.946 -178.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.667 HD12 ' HB3' ' A' ' 87' ' ' LEU . 2.7 mt -85.07 147.58 5.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.655 0.264 . . . . 0.14 110.662 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 23.5 tt0 -137.49 163.04 32.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.817 -0.438 . . . . 1.17 109.817 -179.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -107.12 100.23 9.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.22 0.533 . . . . 0.23 110.184 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 18.8 t -100.37 98.56 7.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.45 -0.795 . . . . 0.16 111.825 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.3 t0 53.44 33.66 16.47 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.108 0.41 . . . . 0.24 112.108 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.76 27.03 15.24 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.638 -0.792 . . . . 0.12 113.08 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -141.85 134.04 27.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.693 0.282 . . . . 1.23 110.95 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.487 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 62.6 mt -74.24 122.7 23.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.445 -0.343 . . . . 0.19 110.673 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -122.65 143.07 50.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.976 0.417 . . . . 1.5 111.488 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 45.6 t80 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 115.924 -0.58 . . . . 1.44 110.734 179.925 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.41 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 15.0 p90 . . . . . 0 N--CA 1.465 0.296 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.893 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.0 tp -61.86 -21.28 25.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.609 0.242 . . . . 0.0 111.379 -179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.49 -26.73 51.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.7 0.286 . . . . 0.0 110.615 179.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.0 p -118.75 18.73 13.32 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.814 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.0 m -135.69 153.87 51.46 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.895 0.379 . . . . 0.0 111.165 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 ptm85 -131.46 172.72 11.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.994 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 48.87 58.14 5.65 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.621 HG21 ' CD1' ' A' ' 5' ' ' ILE . 43.9 p -79.46 134.31 36.53 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.603 ' O ' HD12 ' A' ' 19' ' ' LEU . 27.1 pt20 -158.09 163.68 37.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.605 -179.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.707 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.42 135.9 38.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.244 0.545 . . . . 0.0 110.944 -179.96 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.8 144.84 47.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.141 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.58 -152.8 29.93 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 119.739 -1.22 . . . . 0.0 111.486 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.47 -36.86 18.8 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -140.86 35.74 1.77 Allowed 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -178.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -115.87 148.06 40.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.135 0.493 . . . . 0.0 111.951 178.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.806 ' CB ' HD11 ' A' ' 37' ' ' LEU . 8.6 tp -121.57 124.95 45.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.184 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.09 144.08 48.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.99 0.424 . . . . 0.0 110.206 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.55 172.47 16.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.851 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -112.02 134.86 53.31 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 176.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 82.5 m -130.71 135.07 47.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.206 0.527 . . . . 0.0 112.337 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.06 135.15 53.22 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.438 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.474 HG22 ' O ' ' A' ' 95' ' ' ASP . 79.8 p -84.84 -177.7 6.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.366 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -60.37 -30.64 69.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.768 0.318 . . . . 0.0 111.361 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.06 10.34 8.31 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 66.41 36.05 5.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.11 0.481 . . . . 0.0 111.117 -178.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -115.94 136.32 53.15 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -93.98 125.08 38.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.122 0.487 . . . . 0.0 112.19 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.9 m -131.46 148.5 32.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.623 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.4 m -69.85 136.59 50.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.219 0.533 . . . . 0.0 111.809 -178.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.9 t -143.24 161.64 37.75 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.03 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -142.92 156.89 44.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.483 0.658 . . . . 0.0 112.226 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.458 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -138.08 126.32 30.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.894 -1.048 . . . . 0.0 108.612 179.447 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -89.28 118.76 29.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.793 0.33 . . . . 0.0 110.761 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.806 HD11 ' CB ' ' A' ' 19' ' ' LEU . 4.0 mp -87.99 -14.66 38.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.329 -0.396 . . . . 0.0 112.028 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.438 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.9 p-10 -57.68 -44.39 85.76 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -178.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.438 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 5.9 p30 -92.6 -10.94 35.65 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 122.089 -0.382 . . . . 0.0 111.542 178.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.466 ' HB3' HD12 ' A' ' 41' ' ' ILE . 19.6 m-70 -96.69 -66.34 0.91 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.609 HD12 ' N ' ' A' ' 41' ' ' ILE . 2.1 mp -81.09 150.47 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.001 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.466 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.1 172.14 13.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.809 -178.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.462 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 20.1 t30 -112.75 111.56 22.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.323 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 41.4 mm -110.82 90.25 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.383 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 66.93 38.97 3.44 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.932 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.01 5.38 89.34 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.778 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.4 m -115.96 135.23 54.17 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.912 0.356 . . . . 0.0 110.522 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 19.4 mt -77.39 118.84 20.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.688 0.756 . . . . 0.0 111.58 -177.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -137.97 162.95 32.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.493 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.734 ' CE2' HG11 ' A' ' 90' ' ' VAL . 8.5 m-90 -86.79 121.05 28.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.869 0.366 . . . . 0.0 111.28 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.467 ' O ' ' N ' ' A' ' 53' ' ' SER . 32.4 tt0 -174.89 143.06 0.76 Allowed Pre-proline 0 N--CA 1.464 0.267 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.491 -179.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -62.98 68.37 0.14 Allowed 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.336 2.024 . . . . 0.0 112.994 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.467 ' N ' ' O ' ' A' ' 51' ' ' GLN . 4.7 p -158.96 131.73 6.97 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.422 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.71 109.96 15.74 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -177.543 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -48.0 -30.49 4.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.927 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 62.8 p -49.92 -19.04 0.61 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -179.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 53.5 mm-40 -61.43 -29.41 69.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.576 0.227 . . . . 0.0 110.895 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.462 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -127.95 0.3 5.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.537 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -113.09 148.09 35.97 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.39 0.614 . . . . 0.0 112.295 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -142.07 157.58 44.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.831 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 64.02 44.87 4.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.99 0.424 . . . . 0.0 110.342 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.707 ' O ' HD22 ' A' ' 13' ' ' LEU . 10.2 m -69.16 138.17 53.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.5 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -145.28 153.21 41.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.529 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.406 ' CD1' ' HB2' ' A' ' 19' ' ' LEU . 27.5 mt -129.55 139.4 51.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.193 0.521 . . . . 0.0 111.537 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -133.39 107.92 8.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.172 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.15 -119.73 11.03 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.44 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.2 p -102.91 -3.08 26.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.004 0.402 . . . . 0.0 111.87 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.46 HG13 ' O ' ' A' ' 85' ' ' ILE . 8.0 t -102.32 138.87 24.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-O 121.097 0.475 . . . . 0.0 111.962 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.713 HD22 HD22 ' A' ' 37' ' ' LEU . 3.1 tp -100.43 126.17 46.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.914 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.663 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.4 m -116.85 124.41 49.45 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.231 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.3 t -152.37 153.85 34.45 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 10.4 m -93.41 125.9 38.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 90.8 m -124.91 143.95 50.59 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -178.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . 0.413 ' HG3' ' CE1' ' A' ' 80' ' ' TYR . 16.2 tt0 -74.34 136.14 42.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.894 178.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 6.4 mtm180 -91.83 142.55 27.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.685 0.279 . . . . 0.0 110.68 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.8 m -51.9 -27.09 11.73 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.7 -179.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -83.12 2.59 34.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.786 0.327 . . . . 0.0 111.284 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.86 135.85 6.49 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.542 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.27 -170.03 13.11 Favored Glycine 0 C--N 1.318 -0.418 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 -178.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.413 ' CE1' ' HG3' ' A' ' 74' ' ' GLU . 18.3 m-85 -131.86 143.18 49.98 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 117.411 0.605 . . . . 0.0 111.56 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -153.94 130.07 10.36 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.471 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.6 t -91.86 135.3 34.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.686 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 85.9 p -124.23 158.05 33.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.256 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.75 144.41 49.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.844 0.354 . . . . 0.0 111.092 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.729 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.5 tt -144.71 142.56 23.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.291 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -97.63 117.79 32.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.646 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.613 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 5.8 mt -98.54 -5.16 32.66 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.893 ' ND2' HG22 ' A' ' 5' ' ' ILE . 7.5 t-20 -45.37 -27.99 0.78 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 122.151 -0.343 . . . . 0.0 111.754 -178.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.71 -40.38 25.43 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.734 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.3 m -73.47 -53.15 18.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.598 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.1 mp -80.85 147.95 5.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.972 0.415 . . . . 0.0 111.202 -179.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' A' ' 99' ' ' LYS . 15.2 tt0 -138.07 164.63 28.62 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.838 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -106.42 99.66 9.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.309 0.576 . . . . 0.0 110.365 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 39.2 t -98.98 97.14 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.92 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.474 ' O ' HG22 ' A' ' 25' ' ' THR . 23.2 t0 53.98 31.8 14.19 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.68 0.276 . . . . 0.0 111.565 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.11 28.22 11.15 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.794 -0.717 . . . . 0.0 113.414 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 42.5 m -139.76 136.35 34.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.882 0.372 . . . . 0.0 111.138 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.409 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 77.0 mt -74.04 119.36 18.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.648 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.418 ' O ' ' N ' ' A' ' 92' ' ' GLU . 4.1 mmmt -125.99 137.14 53.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.984 0.421 . . . . 0.0 111.966 -179.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.45 ' CD2' ' CE1' ' A' ' 40' ' ' HIS . 19.5 t80 . . . . . 0 C--N 1.332 -0.16 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.314 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.453 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 16.1 p90 . . . . . 0 N--CA 1.464 0.228 0 CA-C-O 120.688 0.28 . . . . 0.0 111.545 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.942 HG22 ' ND2' ' A' ' 88' ' ' ASN . 6.4 tp -62.24 -21.27 26.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.615 0.245 . . . . 0.0 111.389 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -76.66 -27.33 55.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.742 0.306 . . . . 0.0 111.033 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 50.1 p -118.9 18.37 13.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.664 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 77.8 m -131.42 155.08 47.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.057 0.456 . . . . 0.0 111.545 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -132.51 172.95 11.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.889 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.0 p30 48.82 58.1 5.68 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.566 HG21 ' CD1' ' A' ' 5' ' ' ILE . 40.2 p -79.49 130.77 35.71 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.653 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.4 pt20 -157.05 163.26 39.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.417 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.747 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.86 136.42 38.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.822 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.45 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.06 145.52 46.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.345 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.27 -152.28 33.78 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.788 -1.196 . . . . 0.0 111.325 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.19 -37.17 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.461 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.63 35.36 1.63 Allowed 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.8 OUTLIER -113.71 147.9 37.36 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.937 0.399 . . . . 0.0 111.662 179.016 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.819 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.4 tp -120.11 123.61 43.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.397 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.63 143.69 48.54 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.49 172.51 16.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.214 -178.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -110.07 134.12 52.49 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.484 ' SG ' HD21 ' A' ' 98' ' ' LEU . 75.0 m -130.67 132.91 45.68 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.385 -0.526 . . . . 0.0 112.082 -178.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.5 ptpt -66.93 136.33 55.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.357 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.413 HG22 ' O ' ' A' ' 95' ' ' ASP . 71.2 p -85.21 -176.91 6.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.49 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -62.29 -29.71 70.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.229 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.96 10.35 8.1 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 66.9 38.36 3.68 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.12 0.486 . . . . 0.0 111.511 -178.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.466 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 3.0 mm-40 -118.28 135.92 54.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.979 178.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -93.07 124.85 37.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.8 0.333 . . . . 0.0 111.444 -178.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.5 m -130.99 151.78 36.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.896 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.8 p -71.5 134.29 46.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.173 0.511 . . . . 0.0 111.916 -178.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 t -144.17 161.37 39.04 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.368 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -143.7 156.64 44.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.298 0.571 . . . . 0.0 111.893 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.485 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -136.57 127.59 42.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.302 -0.863 . . . . 0.0 108.977 179.608 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -87.49 116.98 25.98 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.699 0.285 . . . . 0.0 111.531 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.897 HD22 HD22 ' A' ' 69' ' ' LEU . 3.9 mp -87.59 -14.84 39.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.91 179.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.433 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -56.59 -48.24 77.82 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.297 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.419 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -90.96 -10.08 43.68 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 122.13 -0.356 . . . . 0.0 111.384 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 -95.21 -62.98 1.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.603 HD11 HD22 ' A' ' 87' ' ' LEU . 22.7 mm -80.73 151.04 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.839 178.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.56 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.91 172.23 12.97 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.107 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.485 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 34.3 t30 -112.18 108.85 18.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.682 -179.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 50.8 mm -109.64 89.78 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.315 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 43.9 t0 66.21 38.05 4.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.332 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.25 0.63 88.55 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.182 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.4 m -112.08 137.36 50.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.924 0.393 . . . . 0.0 111.003 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 26.8 mt -76.95 117.5 18.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.705 0.764 . . . . 0.0 111.565 -177.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -138.44 162.86 33.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.836 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.803 ' CH2' HD11 ' A' ' 85' ' ' ILE . 4.0 m-90 -84.86 123.13 30.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.039 0.447 . . . . 0.0 111.865 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.56 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -172.17 147.17 1.8 Allowed Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.255 -179.739 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.419 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 51.6 Cg_endo -69.65 63.7 1.73 Allowed 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.231 1.954 . . . . 0.0 112.305 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.402 ' O ' ' O ' ' A' ' 41' ' ' ILE . 3.1 p -158.28 135.15 9.79 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.32 179.111 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.01 109.71 15.86 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.461 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 37.6 p90 -48.92 -29.4 4.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.466 178.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.3 p -48.31 -17.89 0.18 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.883 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -63.75 -29.01 70.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.623 0.249 . . . . 0.0 111.39 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.485 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -127.51 -0.94 6.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.473 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.7 m -110.53 147.97 33.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.202 0.525 . . . . 0.0 111.931 -178.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.7 p90 -142.29 157.61 44.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.045 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.6 m120 64.14 47.29 3.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.947 0.403 . . . . 0.0 110.856 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.747 ' O ' HD22 ' A' ' 13' ' ' LEU . 6.1 m -70.79 135.03 47.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.689 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.12 150.36 42.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.575 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.497 HG13 ' HB2' ' A' ' 13' ' ' LEU . 33.6 mt -128.68 138.76 53.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.376 0.608 . . . . 0.0 111.891 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -136.09 108.19 7.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.16 -0.927 . . . . 0.0 108.963 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.441 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 69.53 -121.36 11.01 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.442 -0.885 . . . . 0.0 111.449 -178.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.45 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.2 p -101.68 -4.17 26.98 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.52 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.2 t -101.41 140.37 20.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.033 0.444 . . . . 0.0 111.99 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.897 HD22 HD22 ' A' ' 37' ' ' LEU . 7.7 tp -102.49 125.97 49.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.349 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.504 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -116.11 124.69 51.0 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.5 t -151.79 153.77 34.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.704 0.287 . . . . 0.0 111.485 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 18.8 m -94.83 126.22 40.01 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 178.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 88.1 m -125.95 144.98 50.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.351 0.596 . . . . 0.0 112.37 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -74.26 137.43 42.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.914 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -91.93 142.5 27.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.665 0.269 . . . . 0.0 110.446 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 56.4 m -52.14 -26.8 12.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.539 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -83.43 2.03 38.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.579 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.45 134.99 6.87 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.774 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.09 -169.14 12.76 Favored Glycine 0 C--N 1.319 -0.41 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -131.04 143.31 50.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 117.337 0.568 . . . . 0.0 111.308 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -153.9 128.85 9.53 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.167 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.7 t -91.97 134.71 34.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.495 -179.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 21.8 p -121.96 158.03 29.97 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.276 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.6 p -123.2 145.02 48.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.878 0.371 . . . . 0.0 110.978 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.803 HD11 ' CH2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -146.99 145.03 19.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.628 -179.822 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.776 ' N ' HD13 ' A' ' 85' ' ' ILE . 46.1 t0 -98.56 117.91 34.07 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.244 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.603 HD22 HD11 ' A' ' 41' ' ' ILE . 6.3 mt -100.1 -6.47 26.26 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.942 ' ND2' HG22 ' A' ' 5' ' ' ILE . 7.0 t-20 -45.01 -27.04 0.5 Allowed 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -178.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.7 m -80.26 -38.34 31.11 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.669 HG11 ' CZ2' ' A' ' 50' ' ' TRP . 3.2 m -75.49 -51.83 19.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -178.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.531 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -81.57 147.49 6.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.034 0.445 . . . . 0.0 111.247 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.44 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 23.1 tt0 -139.08 167.0 23.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.266 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -106.26 99.56 9.14 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.18 0.514 . . . . 0.0 110.378 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.404 ' CG2' ' HG3' ' A' ' 99' ' ' LYS . 58.6 t -97.95 96.51 5.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.999 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.413 ' O ' HG22 ' A' ' 25' ' ' THR . 28.5 t0 53.45 32.84 14.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.632 0.253 . . . . 0.0 111.515 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.44 28.38 11.59 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.831 -0.7 . . . . 0.0 113.345 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.7 m -141.1 135.06 30.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 0.0 111.009 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.484 HD21 ' SG ' ' A' ' 23' ' ' CYS . 54.1 mt -73.39 119.94 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.759 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.3 mttm -123.81 133.95 53.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.467 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.404 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 36.6 t80 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.34 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.46 ' CE2' ' HA ' ' A' ' 88' ' ' ASN . 22.8 p90 . . . . . 0 N--CA 1.466 0.333 0 N-CA-C 111.617 0.229 . . . . 0.0 111.617 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.961 HG22 ' ND2' ' A' ' 88' ' ' ASN . 3.8 tp -64.43 -18.16 22.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.674 0.274 . . . . 0.0 111.272 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.31 -24.19 60.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.873 0.368 . . . . 0.0 110.577 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.4 p -118.46 -3.77 10.9 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.682 179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.8 m -108.19 152.58 24.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.966 0.412 . . . . 0.0 111.482 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -132.09 172.42 12.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.751 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.403 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 6.2 p-10 48.43 58.05 5.6 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.799 HG21 ' CD1' ' A' ' 5' ' ' ILE . 66.9 p -79.67 132.75 36.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.319 178.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.629 ' O ' HD12 ' A' ' 19' ' ' LEU . 19.6 pt20 -158.71 163.95 36.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.192 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.692 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.42 136.38 37.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.147 0.499 . . . . 0.0 110.863 -179.666 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.22 143.81 47.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.098 179.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.29 -152.78 32.9 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 119.89 -1.147 . . . . 0.0 111.462 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -85.83 -37.09 19.59 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.458 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -141.43 36.23 1.67 Allowed 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 8.2 mp0 -115.83 146.67 41.78 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.808 0.337 . . . . 0.0 111.81 178.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.764 ' CB ' HD11 ' A' ' 37' ' ' LEU . 10.7 tp -119.86 124.76 46.86 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.21 142.66 47.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.2 172.72 16.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.189 -178.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -115.45 133.54 55.93 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 177.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.7 m -130.77 135.66 47.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.077 0.465 . . . . 0.0 111.62 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.7 ptpt -66.88 136.93 56.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.675 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.637 HG22 ' O ' ' A' ' 95' ' ' ASP . 42.4 p -84.91 -176.92 6.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.696 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.8 mmt-85 -61.48 -30.48 70.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.801 0.334 . . . . 0.0 110.995 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.12 9.17 9.05 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 66.99 38.81 3.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.317 0.579 . . . . 0.0 111.099 -178.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.434 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 60.8 mt-30 -119.42 134.89 54.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.283 -0.872 . . . . 0.0 108.872 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.406 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 43.4 m-85 -93.09 124.65 37.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.972 0.415 . . . . 0.0 111.544 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.1 m -130.36 153.58 39.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.811 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.24 134.46 44.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.27 0.557 . . . . 0.0 112.186 -178.478 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.8 t -143.59 161.21 39.08 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.28 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.0 ttmt -142.86 156.73 44.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.341 0.591 . . . . 0.0 111.887 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.482 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.03 128.05 49.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.017 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -88.33 115.42 25.82 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.626 0.25 . . . . 0.0 111.296 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.967 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -86.59 -15.44 39.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.344 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.422 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -57.09 -45.22 83.53 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 -178.757 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -91.89 -10.41 39.73 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.477 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 26.8 m-70 -98.33 -63.33 1.14 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.533 HD13 ' CD1' ' A' ' 50' ' ' TRP . 20.6 mm -80.6 147.73 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.952 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.07 172.24 12.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.526 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.473 ' C ' HD12 ' A' ' 44' ' ' ILE . 25.9 t30 -113.11 111.72 22.61 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.164 -179.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.78 HD13 ' HB2' ' A' ' 49' ' ' LYS . 3.0 mp -112.01 89.34 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.909 0.385 . . . . 0.0 111.032 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.7 t0 67.78 38.26 2.97 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.258 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.75 0.88 87.57 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.564 -0.827 . . . . 0.0 113.424 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.4 m -110.72 135.41 51.36 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.307 0.554 . . . . 0.0 110.893 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.7 mt -77.63 118.76 20.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.454 0.645 . . . . 0.0 111.249 -178.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.78 ' HB2' HD13 ' A' ' 44' ' ' ILE . 28.2 mttt -138.99 163.24 32.89 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.514 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.727 ' CE2' HG11 ' A' ' 90' ' ' VAL . 7.7 m-90 -85.89 118.68 25.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.133 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.44 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 43.0 tt0 -174.66 143.14 0.8 Allowed Pre-proline 0 N--CA 1.465 0.31 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.005 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.403 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 28.4 Cg_endo -64.55 74.67 0.2 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.093 1.862 . . . . 0.0 113.164 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -165.75 135.19 3.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.348 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.464 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.69 109.31 15.98 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -177.688 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 38.6 p90 -50.0 -28.41 6.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.808 178.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.1 p -49.32 -16.99 0.21 Allowed 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -63.92 -29.62 70.78 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 122.16 -0.338 . . . . 0.0 111.351 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.458 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -128.2 1.04 5.8 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.073 -0.251 . . . . 0.0 111.479 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.4 m -111.81 147.66 35.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.231 0.538 . . . . 0.0 112.095 -178.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -143.63 157.72 44.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.886 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 64.15 46.33 3.69 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.029 0.442 . . . . 0.0 110.89 -179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.692 ' O ' HD22 ' A' ' 13' ' ' LEU . 35.8 m -70.53 137.6 50.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.097 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.66 151.67 41.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.986 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.477 HG21 HD13 ' A' ' 19' ' ' LEU . 54.4 mt -130.66 138.77 52.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 121.325 0.583 . . . . 0.0 111.889 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -136.03 111.26 9.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.273 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.484 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.82 -121.1 13.65 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.122 -1.037 . . . . 0.0 110.734 -178.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.418 ' HB3' ' HB ' ' A' ' 5' ' ' ILE . 22.5 p -103.07 -3.21 26.25 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.471 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.6 t -100.97 138.19 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 121.028 0.442 . . . . 0.0 111.937 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.967 HD22 HD22 ' A' ' 37' ' ' LEU . 6.8 tp -102.49 124.37 47.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.142 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.465 ' N ' HD12 ' A' ' 69' ' ' LEU . 4.5 m -115.67 126.92 54.75 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 t -152.01 153.86 34.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.768 0.318 . . . . 0.0 111.455 -179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.2 m -93.9 126.13 38.92 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.0 m -126.88 144.93 50.84 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.467 0.651 . . . . 0.0 112.508 -178.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -74.64 137.32 42.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.605 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -90.73 144.72 25.44 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.7 m -51.46 -26.46 8.23 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -83.17 3.07 32.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.634 0.254 . . . . 0.0 111.489 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.32 138.47 7.34 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.089 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.77 -169.83 13.09 Favored Glycine 0 C--N 1.318 -0.448 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -129.5 140.42 51.27 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 117.196 0.498 . . . . 0.0 111.066 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -154.01 128.93 9.49 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.406 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.6 t -93.41 134.87 35.2 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.916 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 37.6 p -121.98 158.3 29.41 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.516 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -122.12 144.52 48.89 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.662 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.653 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.6 tt -145.67 142.58 21.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.605 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -97.38 121.11 38.91 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.078 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.564 ' HB3' HD12 ' A' ' 91' ' ' ILE . 10.2 mt -100.58 -4.16 29.1 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.961 ' ND2' HG22 ' A' ' 5' ' ' ILE . 13.1 t-20 -44.75 -28.44 0.63 Allowed 'General case' 0 N--CA 1.468 0.436 0 O-C-N 122.097 -0.377 . . . . 0.0 111.756 -178.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 49.1 m -81.64 -41.78 20.95 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.727 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.3 m -72.13 -52.75 22.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -177.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.564 HD12 ' HB3' ' A' ' 87' ' ' LEU . 2.6 mp -81.99 145.49 8.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.108 0.48 . . . . 0.0 111.47 -178.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.4 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 9.1 tt0 -135.96 166.25 23.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.062 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -107.95 99.53 8.98 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.27 0.557 . . . . 0.0 110.169 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.2 t -97.63 96.68 5.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.693 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.637 ' O ' HG22 ' A' ' 25' ' ' THR . 22.1 t0 53.42 33.18 15.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.613 0.244 . . . . 0.0 111.599 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.12 28.52 11.67 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.508 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.2 t -140.55 135.33 31.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.901 0.351 . . . . 0.0 110.875 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.429 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 55.6 mt -74.27 120.47 19.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.869 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -127.01 138.09 53.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.892 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.477 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 15.0 t80 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.845 179.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.448 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 17.0 p90 . . . . . 0 N--CA 1.464 0.262 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.952 HG22 ' ND2' ' A' ' 88' ' ' ASN . 6.8 tp -61.83 -22.56 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-O 120.679 0.276 . . . . 0.0 111.498 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -75.24 -24.53 57.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.069 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.8 p -118.05 -3.69 11.09 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 58.2 m -111.14 155.17 23.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.882 0.373 . . . . 0.0 111.069 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -130.22 172.43 11.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.79 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 48.08 59.52 4.19 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.763 HG21 ' CD1' ' A' ' 5' ' ' ILE . 16.6 p -78.78 132.21 36.82 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.766 ' O ' HD12 ' A' ' 19' ' ' LEU . 18.4 pt20 -157.43 163.62 38.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.938 0.399 . . . . 0.0 111.79 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.743 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.47 136.49 37.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.706 179.601 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.86 146.48 46.53 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.223 179.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.64 -153.15 25.12 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 119.771 -1.204 . . . . 0.0 111.365 -178.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.7 m -85.52 -36.95 20.18 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -140.81 36.11 1.79 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 5.0 mp0 -115.23 149.64 37.41 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.153 0.501 . . . . 0.0 112.172 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.801 ' CB ' HD11 ' A' ' 37' ' ' LEU . 19.4 tp -122.45 123.06 40.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.239 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.461 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . . . -119.02 143.98 46.79 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.47 172.82 15.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.302 -178.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -110.98 133.99 52.95 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 61.4 m -130.8 132.08 45.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.052 0.453 . . . . 0.0 111.92 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.11 137.0 56.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.411 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.421 HG22 ' O ' ' A' ' 95' ' ' ASP . 53.3 p -87.3 -177.74 6.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.516 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.9 mmt85 -62.2 -28.94 70.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.557 0.218 . . . . 0.0 111.288 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.36 8.39 9.34 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 66.66 38.0 4.15 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.263 0.554 . . . . 0.0 110.653 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -118.88 136.08 54.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.977 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -92.69 124.74 36.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.931 0.396 . . . . 0.0 111.452 -178.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.2 m -129.81 148.67 33.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.417 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.5 t -71.61 137.15 47.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.179 0.514 . . . . 0.0 111.946 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 t -145.97 162.35 38.01 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.643 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.461 ' HG3' ' HB2' ' A' ' 20' ' ' ALA . 28.8 ttpt -143.88 155.84 44.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.316 0.579 . . . . 0.0 112.043 -179.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.463 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.26 127.77 47.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -89.1 118.6 28.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.72 0.295 . . . . 0.0 110.863 -177.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.801 HD11 ' CB ' ' A' ' 19' ' ' LEU . 3.7 mp -88.96 -16.11 32.57 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.852 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.401 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.1 p-10 -56.57 -43.93 80.47 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -178.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.401 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.3 OUTLIER -92.71 -10.59 36.58 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 122.201 -0.312 . . . . 0.0 111.601 178.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 -96.65 -64.92 1.0 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.626 HD11 HD22 ' A' ' 87' ' ' LEU . 23.2 mm -80.93 148.49 5.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.734 178.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -138.52 172.26 13.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.84 -179.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.412 ' HB2' ' CB ' ' A' ' 55' ' ' PHE . 30.0 t30 -111.96 109.59 19.45 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.464 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 37.8 mm -109.54 88.98 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.678 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 49.8 t0 67.17 39.68 3.03 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.255 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.48 0.75 88.11 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.829 -0.7 . . . . 0.0 113.439 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 39.1 m -113.78 138.23 50.54 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.033 0.444 . . . . 0.0 111.429 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.6 mt -77.17 117.17 18.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.645 0.736 . . . . 0.0 111.118 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 46.4 mttt -135.84 162.49 32.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.859 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.825 ' CH2' HD11 ' A' ' 85' ' ' ILE . 4.9 m-90 -85.33 118.04 24.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.966 0.412 . . . . 0.0 111.149 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.417 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 29.2 tt0 -173.04 142.25 1.02 Allowed Pre-proline 0 N--CA 1.465 0.324 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.705 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.4 ' HD2' ' HG3' ' A' ' 51' ' ' GLN . 34.3 Cg_endo -64.97 73.29 0.23 Allowed 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 121.968 1.779 . . . . 0.0 112.455 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.408 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -162.85 134.57 5.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.69 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.23 109.34 16.42 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.412 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 29.8 p90 -48.5 -30.74 5.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.876 178.477 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.2 p -49.14 -17.82 0.26 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -178.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -62.02 -28.66 69.74 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.136 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.412 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.5 p -128.56 -0.09 5.55 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.387 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.2 m -110.69 148.8 31.52 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -141.1 156.97 45.9 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.248 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 62.96 46.53 4.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.98 0.419 . . . . 0.0 110.632 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.743 ' O ' HD22 ' A' ' 13' ' ' LEU . 73.0 m -69.31 135.96 51.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.188 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.403 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -143.16 152.57 41.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.673 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.52 HD13 HD13 ' A' ' 19' ' ' LEU . 52.4 mt -129.83 140.1 49.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.284 0.564 . . . . 0.0 111.905 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -135.23 108.83 7.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.257 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.449 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.18 -120.95 14.55 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.445 -0.883 . . . . 0.0 111.012 -178.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.455 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.5 p -100.85 -3.17 30.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.144 0.472 . . . . 0.0 111.858 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.568 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.3 t -101.95 138.51 25.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-O 121.01 0.433 . . . . 0.0 111.922 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.784 HD22 HD22 ' A' ' 37' ' ' LEU . 6.6 tp -101.13 124.92 47.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.394 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.462 ' N ' HD12 ' A' ' 69' ' ' LEU . 2.9 m -115.16 125.12 53.05 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.2 t -151.94 154.09 35.38 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.616 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.9 m -93.88 125.81 38.72 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 84.8 m -127.95 145.3 51.01 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 -178.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -75.63 136.47 40.46 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.585 178.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -92.21 146.01 24.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.669 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.3 m -51.79 -27.38 12.12 Favored 'General case' 0 N--CA 1.462 0.155 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -82.95 2.3 35.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.524 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.95 137.79 6.83 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.417 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.19 -169.46 12.89 Favored Glycine 0 C--N 1.319 -0.396 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -178.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -132.03 142.18 49.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.282 0.541 . . . . 0.0 111.15 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -154.32 128.28 8.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.124 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.0 OUTLIER -91.61 134.16 34.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.264 -179.479 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 p -119.29 158.27 26.39 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.588 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 4.4 p -120.15 142.75 48.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.818 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.841 HD13 ' N ' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -148.07 144.95 18.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.529 179.736 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.841 ' N ' HD13 ' A' ' 85' ' ' ILE . 11.0 t70 -100.79 120.73 40.54 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.585 -179.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.626 HD22 HD11 ' A' ' 41' ' ' ILE . 12.1 mt -102.02 -3.25 27.98 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.952 ' ND2' HG22 ' A' ' 5' ' ' ILE . 6.3 t-20 -45.0 -26.96 0.49 Allowed 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.2 m -80.22 -42.17 23.79 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.684 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.7 m -71.63 -52.9 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -178.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.653 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.2 mp -80.53 147.68 6.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.945 0.402 . . . . 0.0 111.342 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.413 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 12.9 tt0 -139.46 167.2 22.63 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.473 -178.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -105.8 99.5 9.1 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.997 0.427 . . . . 0.0 110.639 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.2 t -100.34 94.87 3.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.787 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.421 ' O ' HG22 ' A' ' 25' ' ' THR . 20.5 t0 55.36 32.58 19.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.674 0.273 . . . . 0.0 111.448 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.28 27.87 14.57 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.915 -0.659 . . . . 0.0 113.204 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.3 t -139.05 134.02 32.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.73 0.3 . . . . 0.0 111.059 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.425 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 78.2 mt -72.74 118.78 16.09 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.945 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -124.74 140.5 52.88 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 32.5 t80 . . . . . 0 C--N 1.332 -0.182 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.014 178.998 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.44 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 18.3 p90 . . . . . 0 N--CA 1.464 0.251 0 CA-C-O 120.702 0.287 . . . . 0.0 111.349 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.952 HG22 ' ND2' ' A' ' 88' ' ' ASN . 6.7 tp -66.24 -13.18 15.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -77.54 -26.82 51.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.891 0.377 . . . . 0.0 110.878 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.2 p -118.56 0.34 11.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.528 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 76.0 m -112.31 153.44 27.21 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 121.015 0.436 . . . . 0.0 111.047 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.8 ptt180 -132.57 172.6 12.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.989 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 48.91 58.0 5.82 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.655 HG21 ' CD1' ' A' ' 5' ' ' ILE . 8.4 p -79.32 131.64 36.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.979 178.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.753 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.8 pt20 -155.97 163.01 40.27 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.4 -179.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.751 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.42 135.79 38.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.546 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.86 144.34 47.43 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.272 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.38 -151.71 31.34 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 119.799 -1.191 . . . . 0.0 111.3 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.65 -37.06 18.38 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -140.54 35.44 1.83 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.4 mp0 -115.15 146.89 40.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.059 0.457 . . . . 0.0 111.781 179.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.808 ' CB ' HD11 ' A' ' 37' ' ' LEU . 14.6 tp -122.04 124.25 43.52 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.014 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.81 144.07 46.54 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.935 0.398 . . . . 0.0 110.141 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.31 172.35 16.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.17 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -114.57 134.05 55.34 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 177.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.431 ' SG ' HD21 ' A' ' 98' ' ' LEU . 55.7 m -130.57 134.15 46.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.281 0.563 . . . . 0.0 111.894 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.2 ptpt -66.04 137.48 57.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.423 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.635 HG22 ' O ' ' A' ' 95' ' ' ASP . 66.0 p -85.9 -176.43 5.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.644 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -62.93 -30.56 71.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.231 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.81 9.68 7.61 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 66.88 37.67 3.94 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.132 0.492 . . . . 0.0 111.425 -178.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.442 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 54.4 mt-30 -117.25 137.69 52.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.009 177.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -94.85 125.06 39.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.859 0.361 . . . . 0.0 111.849 -178.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 m -131.04 151.05 35.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.0 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.7 p -71.92 135.8 46.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.246 0.546 . . . . 0.0 111.876 -178.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.4 t -143.26 161.42 38.33 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.214 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.4 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 13.4 ttmt -142.2 156.1 45.31 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.411 0.624 . . . . 0.0 111.933 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.422 HG23 ' O ' ' A' ' 35' ' ' ILE . 1.3 tp -138.42 125.0 26.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.115 -0.948 . . . . 0.0 108.818 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -86.8 119.13 26.7 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.677 0.275 . . . . 0.0 111.153 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.856 HD22 HD22 ' A' ' 69' ' ' LEU . 4.4 mp -87.99 -16.0 34.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.634 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.444 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -57.69 -44.81 86.11 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.444 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.4 OUTLIER -91.76 -10.4 40.11 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 122.106 -0.371 . . . . 0.0 111.061 179.285 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.438 ' HB3' HD12 ' A' ' 41' ' ' ILE . 23.6 m-70 -97.87 -68.43 0.8 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.623 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.7 mp -78.59 150.67 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.287 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.439 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.09 172.58 12.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.953 -179.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.491 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 26.8 t30 -111.34 109.45 19.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.083 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 33.3 mm -109.88 89.69 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.407 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 55.6 t0 68.0 38.78 2.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.259 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.16 0.7 89.61 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.824 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.9 m -112.81 136.94 51.85 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.863 0.363 . . . . 0.0 110.882 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.415 HD22 HG21 ' A' ' 41' ' ' ILE . 13.5 mt -77.41 117.39 18.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.638 0.733 . . . . 0.0 111.281 -178.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.1 mttm -137.51 162.7 33.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.721 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.757 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.2 m-90 -87.27 121.89 30.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.087 0.47 . . . . 0.0 111.561 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 53' ' ' SER . 3.2 tp60 -175.06 143.39 0.76 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.873 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.402 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 23.4 Cg_endo -62.41 69.43 0.12 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.208 1.939 . . . . 0.0 112.553 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -160.49 134.75 7.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.834 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.431 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -82.49 108.42 15.88 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.158 0.504 . . . . 0.0 112.027 -178.068 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.44 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 33.4 p90 -47.63 -31.33 4.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.301 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 45.8 p -47.78 -16.25 0.07 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.316 -0.857 . . . . 0.0 113.006 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -64.56 -26.83 68.59 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.559 0.219 . . . . 0.0 111.381 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.491 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -134.01 5.41 3.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.322 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.6 m -115.18 148.98 38.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.228 0.537 . . . . 0.0 111.837 -178.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -142.84 157.63 44.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.968 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.4 m-20 63.34 46.07 4.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.981 0.42 . . . . 0.0 110.954 -179.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.751 ' O ' HD22 ' A' ' 13' ' ' LEU . 43.2 m -69.59 136.02 50.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.496 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.33 151.03 43.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.511 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.514 HG13 ' HB2' ' A' ' 13' ' ' LEU . 52.2 mt -129.81 140.89 47.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.225 0.536 . . . . 0.0 111.728 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -138.13 110.4 7.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.01 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.36 -122.28 14.77 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.269 -0.967 . . . . 0.0 111.101 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.436 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.3 p -101.32 -2.37 31.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.5 t -102.63 138.62 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.012 0.434 . . . . 0.0 112.109 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.856 HD22 HD22 ' A' ' 37' ' ' LEU . 8.7 tp -102.53 126.93 49.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.329 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.446 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -117.56 125.95 51.72 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.4 t -151.83 153.43 34.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.607 0.241 . . . . 0.0 111.16 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 18.5 m -94.2 126.02 39.18 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 85.4 m -126.45 145.15 50.6 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -74.51 136.52 42.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.772 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.1 mtm180 -91.72 143.61 26.37 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 69.2 m -51.83 -27.23 11.82 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -83.67 2.28 38.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.65 0.262 . . . . 0.0 111.531 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.81 136.95 7.4 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.911 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.96 -169.73 13.07 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 111.101 -0.8 . . . . 0.0 111.101 -178.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -130.8 142.04 50.38 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 117.304 0.552 . . . . 0.0 111.22 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -154.15 129.13 9.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.517 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -92.75 134.33 35.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.271 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.3 p -122.77 158.18 30.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.377 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 57.8 p -121.01 144.88 48.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.906 0.384 . . . . 0.0 111.059 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.628 HD11 ' CH2' ' A' ' 50' ' ' TRP . 13.5 tt -144.21 143.0 23.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.399 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -96.88 115.86 28.17 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.995 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.605 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 16.1 mt -95.91 -7.19 37.38 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.952 ' ND2' HG22 ' A' ' 5' ' ' ILE . 13.9 t-20 -44.7 -27.83 0.54 Allowed 'General case' 0 N--CA 1.467 0.392 0 O-C-N 122.178 -0.326 . . . . 0.0 111.869 -178.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.88 -37.88 26.22 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.757 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -74.36 -53.87 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 -178.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.552 HD12 ' HB3' ' A' ' 87' ' ' LEU . 3.0 mp -80.95 147.78 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.05 0.452 . . . . 0.0 111.465 -178.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.424 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 14.4 tt0 -138.07 164.45 29.08 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.852 -178.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 20.8 t30 -106.67 99.72 9.28 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.087 0.47 . . . . 0.0 110.528 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.453 ' HB ' ' CE ' ' A' ' 99' ' ' LYS . 39.1 t -99.86 96.65 5.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.187 179.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.635 ' O ' HG22 ' A' ' 25' ' ' THR . 19.2 t0 53.62 33.0 15.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.66 28.79 13.23 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.697 -0.763 . . . . 0.0 113.054 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -141.91 134.33 28.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.746 0.308 . . . . 0.0 110.925 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.431 HD21 ' SG ' ' A' ' 23' ' ' CYS . 49.8 mt -75.06 119.14 18.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.12 0.486 . . . . 0.0 111.51 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.453 ' CE ' ' HB ' ' A' ' 94' ' ' VAL . 0.9 OUTLIER -122.85 153.41 39.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.084 179.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 53.9 t80 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.928 -179.792 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.443 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 19.6 p90 . . . . . 0 N--CA 1.465 0.284 0 CA-C-O 120.645 0.26 . . . . 0.0 111.543 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.929 HG22 ' ND2' ' A' ' 88' ' ' ASN . 7.8 tp -63.02 -19.84 24.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.673 0.273 . . . . 0.0 111.393 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.506 ' OE2' HG23 ' A' ' 5' ' ' ILE . 38.2 mm-40 -78.48 -26.37 46.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.766 0.317 . . . . 0.0 110.726 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.6 p -118.32 13.83 13.71 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.984 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.9 m -129.77 156.2 44.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.933 0.397 . . . . 0.0 111.167 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.34 172.5 12.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.034 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 47.98 58.56 4.95 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.771 HG21 ' CD1' ' A' ' 5' ' ' ILE . 30.0 p -79.06 132.79 36.73 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.655 ' O ' HD12 ' A' ' 19' ' ' LEU . 3.7 pt20 -157.36 163.81 38.22 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.973 0.416 . . . . 0.0 111.453 -179.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.769 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.49 136.1 38.4 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.035 -179.835 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.444 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -118.6 143.45 46.79 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.04 -150.75 31.93 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 119.877 -1.154 . . . . 0.0 111.712 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -87.21 -36.62 17.87 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -178.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.425 ' OG ' ' HB3' ' A' ' 38' ' ' ASP . 3.1 p -140.69 35.07 1.8 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 3.0 mp0 -115.45 148.02 39.9 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.205 0.526 . . . . 0.0 112.123 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.816 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.8 tp -122.06 123.83 42.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.319 179.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.29 143.61 47.25 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.19 172.33 16.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.081 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -111.27 133.56 53.51 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 86.1 m -131.01 134.2 46.47 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.416 -0.514 . . . . 0.0 112.277 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 5.3 ptpt -67.11 137.42 56.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.728 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.59 HG22 ' O ' ' A' ' 95' ' ' ASP . 36.2 p -86.05 -178.96 6.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.602 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -61.41 -29.13 69.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.709 0.29 . . . . 0.0 111.222 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.16 10.41 8.35 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 66.51 36.33 5.07 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.138 0.494 . . . . 0.0 111.345 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.414 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 4.3 mt-30 -116.42 137.61 52.02 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -93.92 125.3 38.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.945 0.402 . . . . 0.0 111.864 -178.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.4 m -131.0 150.74 34.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.696 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -72.53 135.96 45.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.145 0.498 . . . . 0.0 111.968 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.6 t -143.7 161.38 38.73 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.208 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -141.93 157.24 45.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.509 0.671 . . . . 0.0 112.283 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.535 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.3 tp -138.47 125.79 27.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.076 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -87.88 119.13 27.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.664 0.268 . . . . 0.0 110.998 -178.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.863 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -88.31 -14.54 38.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.5 p-10 -58.49 -43.46 89.02 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.455 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.9 OUTLIER -92.16 -10.94 36.97 Favored 'General case' 0 N--CA 1.465 0.306 0 O-C-N 122.096 -0.377 . . . . 0.0 111.8 179.568 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.451 ' CE1' ' CD2' ' A' ' 100' ' ' TYR . 38.9 m-70 -97.8 -59.77 1.7 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.628 HD11 HD22 ' A' ' 87' ' ' LEU . 32.5 mm -81.28 146.16 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.575 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.494 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -139.02 170.34 16.16 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.298 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.449 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 29.8 t30 -112.95 109.68 19.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.53 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.2 mm -110.02 89.6 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.069 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.4 t0 68.52 39.43 2.13 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.089 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.28 5.57 89.5 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.864 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 m -115.23 136.42 53.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.793 0.33 . . . . 0.0 110.821 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.585 HD22 HG21 ' A' ' 41' ' ' ILE . 27.8 mt -77.53 116.15 17.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.666 0.746 . . . . 0.0 111.333 -178.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 mmtt -136.34 162.63 32.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.192 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.72 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 7.7 m-90 -86.07 123.47 31.41 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.323 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.494 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 2.8 mt-30 -172.03 152.6 2.95 Favored Pre-proline 0 N--CA 1.465 0.323 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.773 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.06 63.26 4.14 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.023 1.815 . . . . 0.0 112.359 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 4.4 p -155.92 135.03 12.11 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.506 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -81.22 109.56 15.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.182 0.515 . . . . 0.0 112.259 -177.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -47.3 -30.59 3.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.708 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 81.9 p -48.58 -18.12 0.22 Allowed 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -61.21 -28.07 68.89 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.933 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.449 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 6.1 p -130.7 1.34 4.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.3 m -111.47 149.18 31.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.192 0.52 . . . . 0.0 112.336 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.6 p90 -141.55 156.56 45.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.817 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 63.98 47.22 3.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.884 0.373 . . . . 0.0 111.242 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.769 ' O ' HD22 ' A' ' 13' ' ' LEU . 73.4 m -69.92 134.89 48.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.453 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.72 152.14 43.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.599 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.459 HG13 ' HB2' ' A' ' 13' ' ' LEU . 39.5 mt -128.92 138.06 55.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.4 0.619 . . . . 0.0 112.034 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -133.77 106.46 7.35 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.079 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.31 -121.89 11.96 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.49 -0.862 . . . . 0.0 111.58 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.429 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 24.3 p -99.41 -4.4 31.61 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.458 HG13 ' O ' ' A' ' 85' ' ' ILE . 3.5 t -102.04 140.51 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 121.109 0.48 . . . . 0.0 112.191 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.863 HD22 HD22 ' A' ' 37' ' ' LEU . 9.3 tp -102.55 126.12 49.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.085 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.418 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.0 m -116.0 125.29 52.3 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.218 -0.289 . . . . 0.0 110.218 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.6 t -152.02 153.59 34.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.612 0.244 . . . . 0.0 111.353 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 22.1 m -95.05 126.44 40.39 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 76.6 m -126.02 145.06 50.47 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -74.5 136.58 42.21 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.848 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -93.2 144.37 25.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.691 0.282 . . . . 0.0 111.119 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.3 m -52.02 -28.83 18.49 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.635 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -82.61 1.7 36.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.638 0.256 . . . . 0.0 111.479 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.07 136.15 7.19 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.707 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.5 -170.91 13.47 Favored Glycine 0 C--N 1.319 -0.392 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 -178.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -129.54 143.12 50.69 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 117.286 0.543 . . . . 0.0 111.059 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -153.81 130.13 10.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.174 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.9 t -92.7 134.89 34.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.636 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 26.4 p -122.21 157.79 30.83 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.197 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.1 p -123.69 145.09 49.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.861 0.362 . . . . 0.0 111.086 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.72 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.3 tt -146.34 142.79 21.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.762 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -96.77 118.31 32.94 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.131 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.628 HD22 HD11 ' A' ' 41' ' ' ILE . 9.5 mt -97.4 -6.82 33.18 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.929 ' ND2' HG22 ' A' ' 5' ' ' ILE . 9.3 t-20 -45.06 -28.7 0.74 Allowed 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -178.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.9 m -80.59 -40.67 25.34 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.685 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.7 m -72.8 -50.82 30.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 113.067 0.765 . . . . 0.0 113.067 -178.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.594 HD12 ' HB3' ' A' ' 87' ' ' LEU . 2.6 mp -82.93 147.35 5.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.137 0.494 . . . . 0.0 111.461 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 4.9 tt0 -138.96 166.83 23.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.96 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -108.02 99.91 9.3 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.059 0.457 . . . . 0.0 110.743 -179.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.43 HG21 ' HG3' ' A' ' 99' ' ' LYS . 48.2 t -99.17 96.88 5.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.848 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.59 ' O ' HG22 ' A' ' 25' ' ' THR . 30.0 t0 52.6 33.67 14.1 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.37 28.35 11.72 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.579 -0.82 . . . . 0.0 113.3 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -140.99 134.11 29.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.907 0.384 . . . . 0.0 111.2 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.414 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 59.3 mt -73.5 119.56 17.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.529 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.43 ' HG3' HG21 ' A' ' 94' ' ' VAL . 2.3 mmmt -125.18 141.75 51.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.194 0.521 . . . . 0.0 111.985 -179.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.451 ' CD2' ' CE1' ' A' ' 40' ' ' HIS . 46.1 t80 . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.659 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.464 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 31.0 p90 . . . . . 0 N--CA 1.464 0.253 0 CA-C-O 120.724 0.297 . . . . 0.0 111.127 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.96 HG22 ' ND2' ' A' ' 88' ' ' ASN . 6.8 tp -63.87 -17.63 20.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.736 0.303 . . . . 0.0 111.161 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.62 -26.47 54.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.959 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.0 p -118.67 18.59 13.4 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.183 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.3 m -134.41 154.91 51.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.968 0.413 . . . . 0.0 111.063 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.412 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 1.6 ptm180 -134.25 172.8 12.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.19 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.412 ' OD1' ' O ' ' A' ' 9' ' ' ARG . 6.3 p-10 49.04 57.4 6.5 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.3 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.614 HG21 ' CD1' ' A' ' 5' ' ' ILE . 4.2 p -79.58 134.14 36.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.88 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.758 ' O ' HD12 ' A' ' 19' ' ' LEU . 3.1 pt20 -158.35 163.66 37.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.388 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.761 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.31 135.85 38.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.156 0.503 . . . . 0.0 110.73 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.28 146.12 46.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.085 179.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.78 -153.33 25.31 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.814 -1.184 . . . . 0.0 111.408 -179.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.0 -36.85 19.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -141.04 36.23 1.74 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.9 OUTLIER -116.05 146.09 42.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.168 0.509 . . . . 0.0 111.881 179.172 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.758 HD12 ' O ' ' A' ' 12' ' ' GLN . 15.2 tp -120.89 125.07 46.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.175 178.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.6 143.93 47.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.858 0.361 . . . . 0.0 110.031 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.28 172.51 16.51 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.386 -178.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.15 133.54 54.23 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.2 m -130.77 132.82 45.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.158 0.504 . . . . 0.0 112.043 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.1 ptpt -66.52 135.73 54.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.105 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.0 p -85.89 -176.28 5.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.633 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.1 mtt-85 -61.46 -29.91 70.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.742 0.306 . . . . 0.0 111.257 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.76 8.86 9.0 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 66.53 37.06 4.69 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.169 0.509 . . . . 0.0 111.059 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.425 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.0 OUTLIER -118.24 136.33 53.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.995 178.103 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -92.64 125.47 37.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.921 0.391 . . . . 0.0 111.858 -178.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.1 m -129.87 152.56 37.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.828 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.4 t -72.75 133.54 44.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.178 0.513 . . . . 0.0 111.592 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -142.11 161.37 38.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.272 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -142.5 154.99 45.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.407 0.622 . . . . 0.0 112.206 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.573 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -136.41 124.87 36.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.821 179.18 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -88.64 120.29 29.9 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.683 0.278 . . . . 0.0 111.036 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.849 HD22 HD22 ' A' ' 69' ' ' LEU . 4.5 mp -88.05 -14.52 38.73 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.5 p-10 -57.49 -45.06 85.34 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -178.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.8 OUTLIER -92.3 -10.53 38.03 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 122.106 -0.371 . . . . 0.0 111.569 179.434 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -98.12 -65.56 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.604 HG13 HD23 ' A' ' 37' ' ' LEU . 15.7 mm -80.48 150.16 4.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.708 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.504 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.18 172.29 12.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.726 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.474 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 24.9 t30 -112.71 110.57 20.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.373 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.8 mm -110.86 89.62 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.042 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.4 t70 68.71 39.19 2.04 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.908 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.75 0.66 90.29 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.978 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.1 m -110.53 136.74 49.19 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.933 0.397 . . . . 0.0 110.858 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.9 mt -77.08 116.31 17.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.544 0.687 . . . . 0.0 111.012 -178.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 31.4 mttt -135.25 161.92 34.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.015 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.732 ' CE2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -86.58 119.15 26.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.938 0.399 . . . . 0.0 111.19 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.504 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 1.3 tp-100 -175.51 141.56 0.64 Allowed Pre-proline 0 C--N 1.331 -0.208 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.201 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.47 76.17 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.265 1.977 . . . . 0.0 112.781 -179.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -166.89 135.41 2.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.665 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.08 108.99 15.99 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.416 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 25.4 p90 -49.51 -31.0 9.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.761 178.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.1 p -48.9 -16.77 0.14 Allowed 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -179.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -63.27 -29.53 70.84 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.15 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.474 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -128.89 1.86 5.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.286 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.7 m -112.79 147.93 35.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.244 0.545 . . . . 0.0 111.864 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 26.6 p90 -143.21 157.74 44.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.929 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 63.32 44.24 5.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.006 0.432 . . . . 0.0 110.485 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.761 ' O ' HD22 ' A' ' 13' ' ' LEU . 20.5 m -69.08 137.14 53.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.466 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.405 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.87 152.89 42.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.596 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.488 ' CD1' HD13 ' A' ' 19' ' ' LEU . 33.8 mt -129.72 140.44 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-O 121.288 0.566 . . . . 0.0 111.805 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -136.19 108.55 7.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.791 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.411 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.93 -120.84 12.97 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.431 -0.89 . . . . 0.0 111.243 -178.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.402 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.9 p -101.72 -3.67 27.78 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -179.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.1 t -101.88 139.23 23.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.977 0.418 . . . . 0.0 111.756 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.849 HD22 HD22 ' A' ' 37' ' ' LEU . 10.6 tp -100.93 125.12 47.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.332 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.6 m -115.6 123.49 48.56 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.2 t -151.92 153.83 34.91 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.41 -178.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 6.3 m -94.18 125.78 39.02 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 88.0 m -126.01 143.95 50.9 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -74.13 136.84 42.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.753 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . 0.414 ' NH1' ' HB3' ' A' ' 75' ' ' ARG . 12.5 mtp-105 -92.15 144.21 25.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.724 0.297 . . . . 0.0 110.503 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.2 m -52.06 -27.12 12.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.749 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -83.56 2.39 37.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.617 0.246 . . . . 0.0 111.651 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.73 136.26 7.07 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.687 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.62 -169.6 12.99 Favored Glycine 0 C--N 1.318 -0.434 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 -178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -130.0 142.05 50.67 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.266 0.533 . . . . 0.0 111.123 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -153.79 128.74 9.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.203 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.7 t -93.12 134.69 35.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.607 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.3 p -122.9 158.35 30.56 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.443 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 14.9 m -122.71 145.64 48.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.902 0.382 . . . . 0.0 111.201 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.717 HD11 ' CH2' ' A' ' 50' ' ' TRP . 9.9 tt -145.33 143.72 21.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.812 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -97.1 116.29 29.04 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.745 179.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.548 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 11.2 mt -97.62 -4.54 37.32 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.96 ' ND2' HG22 ' A' ' 5' ' ' ILE . 12.4 t-20 -44.92 -27.72 0.57 Allowed 'General case' 0 N--CA 1.466 0.342 0 O-C-N 122.155 -0.341 . . . . 0.0 111.874 -178.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.5 -41.28 21.95 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.732 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.5 m -72.67 -52.33 23.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.653 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -83.13 147.37 5.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.103 0.477 . . . . 0.0 111.279 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 16.9 tt0 -139.92 167.09 22.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.14 -178.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -107.37 99.9 9.38 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.101 0.477 . . . . 0.0 110.805 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 58.8 t -98.53 97.48 6.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.007 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.7 t0 53.07 33.74 15.65 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.27 28.31 11.9 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.662 -0.78 . . . . 0.0 113.111 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.7 m -141.58 135.7 30.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.871 0.367 . . . . 0.0 111.279 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.482 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 63.0 mt -74.24 120.48 19.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.801 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.445 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 14.7 mttt -123.87 137.46 54.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.36 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.429 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 34.9 t80 . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.791 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.2 p90 . . . . . 0 N--CA 1.463 0.199 0 CA-C-O 120.47 0.176 . . . . 0.0 111.348 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.949 HG22 ' ND2' ' A' ' 88' ' ' ASN . 5.8 tp -67.7 -11.74 14.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.365 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -76.74 -26.08 54.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.834 0.35 . . . . 0.0 110.552 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.0 p -118.37 -3.35 10.97 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.447 179.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 70.6 m -108.11 150.6 26.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.126 0.488 . . . . 0.0 111.402 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.401 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.4 ptm180 -131.87 172.47 12.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.506 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.406 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.8 p-10 49.45 56.97 7.02 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.062 0.458 . . . . 0.0 111.685 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.707 HG21 ' CD1' ' A' ' 5' ' ' ILE . 8.3 p -79.32 132.59 36.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.691 178.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.726 ' O ' HD12 ' A' ' 19' ' ' LEU . 2.6 pt20 -158.14 163.89 37.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.44 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.72 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.31 136.38 37.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.028 -179.624 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.81 143.59 47.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.163 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.07 -152.27 33.03 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 119.78 -1.2 . . . . 0.0 111.324 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.23 -36.74 19.23 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.1 p -140.9 34.96 1.76 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -178.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -115.22 148.8 38.66 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.073 0.463 . . . . 0.0 111.662 178.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.766 ' CB ' HD11 ' A' ' 37' ' ' LEU . 12.6 tp -122.97 124.9 44.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.346 179.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.06 144.15 46.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.3 172.48 16.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.117 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -116.51 133.38 56.09 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 177.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.416 ' SG ' HD21 ' A' ' 98' ' ' LEU . 17.2 m -130.73 136.77 49.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.027 0.441 . . . . 0.0 111.893 -178.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.3 ptpt -66.74 137.9 56.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.481 -179.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.465 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.2 p -86.44 -175.78 5.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.879 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -61.64 -31.41 71.51 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 111.523 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.63 9.61 9.14 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 66.84 39.7 3.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.274 0.559 . . . . 0.0 111.381 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.43 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 74.8 mt-30 -118.82 136.65 53.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.664 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -93.77 124.82 38.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.898 0.38 . . . . 0.0 111.641 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.7 m -131.5 148.92 32.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.584 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 73.3 m -71.5 138.57 49.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.328 0.585 . . . . 0.0 112.044 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.6 t -143.94 161.25 39.19 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.18 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmmm? -139.87 154.61 47.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.396 0.617 . . . . 0.0 112.42 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.446 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.3 tp -137.78 125.08 29.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.048 -0.978 . . . . 0.0 108.925 179.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -88.97 120.61 30.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.728 0.299 . . . . 0.0 111.071 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.97 HD22 HD22 ' A' ' 69' ' ' LEU . 4.6 mp -88.98 -15.75 33.41 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.982 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.3 p-10 -57.82 -43.06 85.48 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -178.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.424 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 7.9 p-10 -92.77 -11.34 34.06 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 122.135 -0.353 . . . . 0.0 111.493 179.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.436 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 22.9 m-70 -97.61 -65.95 0.93 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.616 HD12 ' N ' ' A' ' 41' ' ' ILE . 2.1 mp -80.77 148.78 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.172 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.3 170.84 14.96 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.116 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.538 ' C ' HD12 ' A' ' 44' ' ' ILE . 19.4 t30 -113.03 113.23 25.17 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.926 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.743 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.4 mp -113.16 89.44 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.028 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 69.62 36.83 2.05 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.006 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.81 1.31 85.25 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.695 -0.764 . . . . 0.0 113.467 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 18.1 m -111.69 135.81 51.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 117.252 0.526 . . . . 0.0 111.255 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.3 mt -77.59 116.92 18.54 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.648 0.737 . . . . 0.0 111.599 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.743 ' HB2' HD13 ' A' ' 44' ' ' ILE . 9.8 mttm -137.82 162.74 33.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.921 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.881 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 11.6 m-90 -87.02 121.8 29.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.882 0.372 . . . . 0.0 111.184 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.42 ' O ' ' N ' ' A' ' 53' ' ' SER . 35.2 tt0 -175.6 144.75 0.77 Allowed Pre-proline 0 N--CA 1.464 0.231 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.984 -179.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.424 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 29.9 Cg_endo -64.45 71.56 0.21 Allowed 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.084 1.856 . . . . 0.0 112.785 -179.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 51' ' ' GLN . 4.0 p -162.86 133.31 4.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.527 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -81.07 110.18 16.35 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -177.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.424 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 37.8 p90 -48.83 -29.38 4.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.402 178.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 74.8 p -48.65 -19.08 0.31 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.843 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -61.58 -30.49 70.71 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.34 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.426 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -127.96 -0.19 5.94 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.146 -0.222 . . . . 0.0 111.496 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -110.95 149.19 31.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.247 0.546 . . . . 0.0 112.292 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -143.02 157.43 44.55 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.102 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 64.03 46.52 3.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.003 0.43 . . . . 0.0 110.536 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.72 ' O ' HD22 ' A' ' 13' ' ' LEU . 26.9 m -69.51 136.7 51.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.71 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.451 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.27 151.56 42.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.686 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.53 HG21 HD13 ' A' ' 19' ' ' LEU . 37.5 mt -130.6 139.04 52.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.354 0.597 . . . . 0.0 111.738 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -136.44 111.08 8.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.21 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.49 -121.26 17.14 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.161 -1.019 . . . . 0.0 110.934 -178.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.452 ' HB3' HG21 ' A' ' 5' ' ' ILE . 23.0 p -101.07 -3.88 28.44 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.515 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.7 t -101.67 138.43 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.97 HD22 HD22 ' A' ' 37' ' ' LEU . 7.9 tp -102.56 123.78 46.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.127 179.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.426 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.3 m -114.48 125.86 54.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 t -151.57 153.83 35.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.774 0.321 . . . . 0.0 111.494 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 8.5 m -93.91 126.18 38.96 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 82.7 m -126.03 142.74 51.39 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -75.58 140.1 42.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.799 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -92.82 143.51 26.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.686 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 37.3 m -51.94 -29.78 21.78 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.753 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.47 3.02 29.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.578 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.79 134.68 6.9 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.793 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 118.27 -174.77 15.43 Favored Glycine 0 C--N 1.318 -0.448 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -178.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -129.34 141.74 51.0 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 117.356 0.578 . . . . 0.0 110.845 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -153.95 130.31 10.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.424 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.1 t -92.51 134.49 34.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.48 -179.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.8 p -121.42 157.88 29.56 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.901 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -123.14 146.2 47.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.866 0.365 . . . . 0.0 111.301 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.881 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.7 tt -146.43 143.3 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.869 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -95.98 117.02 29.82 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.848 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.686 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 10.1 mt -96.1 -5.19 41.39 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -178.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.949 ' ND2' HG22 ' A' ' 5' ' ' ILE . 10.3 t-20 -44.73 -27.63 0.52 Allowed 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.1 m -81.1 -39.67 25.31 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.74 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -73.49 -53.43 18.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -177.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.606 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.89 147.13 6.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.175 0.512 . . . . 0.0 112.042 -178.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.45 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 12.5 tt0 -138.96 166.17 25.18 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.923 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -107.58 99.75 9.22 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.193 0.52 . . . . 0.0 110.767 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.481 HG11 ' HE3' ' A' ' 99' ' ' LYS . 40.6 t -97.93 96.98 5.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.745 179.136 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.465 ' O ' HG22 ' A' ' 25' ' ' THR . 22.3 t0 54.07 33.11 16.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.704 0.288 . . . . 0.0 111.56 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.56 28.45 12.67 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 120.723 -0.751 . . . . 0.0 113.223 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 68.0 p -140.33 135.94 32.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.898 0.38 . . . . 0.0 111.219 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.45 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 31.2 mt -74.21 119.35 18.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.067 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.481 ' HE3' HG11 ' A' ' 94' ' ' VAL . 7.1 mttt -124.29 138.25 54.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.447 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.436 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 32.5 t80 . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.01 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.437 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 19.7 p90 . . . . . 0 N--CA 1.466 0.336 0 CA-C-O 120.633 0.254 . . . . 0.0 111.444 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.949 HG22 ' ND2' ' A' ' 88' ' ' ASN . 3.8 tp -65.5 -14.43 16.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.707 0.289 . . . . 0.0 111.129 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 mp0 -76.33 -27.23 56.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.786 0.327 . . . . 0.0 110.528 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.3 p -119.23 19.1 12.92 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.181 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.9 m -131.35 154.86 48.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.136 0.494 . . . . 0.0 111.771 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -134.93 173.07 12.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.065 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 p30 49.32 57.12 6.83 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.706 HG21 ' CD1' ' A' ' 5' ' ' ILE . 4.9 p -79.54 130.55 35.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.63 178.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.634 ' O ' HD12 ' A' ' 19' ' ' LEU . 3.4 pt20 -156.43 163.26 39.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.64 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.682 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.98 136.6 38.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.187 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.88 143.17 48.08 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.462 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.3 -150.1 37.93 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.025 -1.083 . . . . 0.0 111.82 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.69 -37.1 18.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -143.23 35.64 1.35 Allowed 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -114.43 146.57 40.45 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.815 0.34 . . . . 0.0 111.484 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.775 ' HB3' HD11 ' A' ' 37' ' ' LEU . 9.9 tp -120.29 123.21 42.6 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.18 144.63 47.6 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.56 172.55 16.17 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.876 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -112.3 134.31 53.91 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 177.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.0 m -130.46 134.83 47.4 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.39 -0.524 . . . . 0.0 112.228 -178.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 6.3 ptpt -67.3 135.51 53.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.326 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.585 HG22 ' O ' ' A' ' 95' ' ' ASP . 64.1 p -85.16 -179.33 6.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.27 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 45.8 mtt-85 -59.3 -29.69 67.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.559 -179.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.79 10.68 8.94 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 66.9 39.27 3.39 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.025 0.441 . . . . 0.0 112.005 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -121.44 132.63 54.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.445 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 46.8 m-85 -90.65 126.46 35.98 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.108 0.48 . . . . 0.0 111.922 -178.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.1 m -131.06 151.61 36.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.793 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 41.5 m -71.06 134.6 47.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.228 0.537 . . . . 0.0 111.948 -178.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.3 t -142.11 161.82 37.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.284 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.11 156.02 45.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.321 0.582 . . . . 0.0 112.394 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.455 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -138.46 125.0 25.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.113 -0.949 . . . . 0.0 108.774 179.25 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -87.17 115.92 24.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.649 0.261 . . . . 0.0 111.199 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.865 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -87.17 -16.29 35.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.391 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.86 -45.84 74.62 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.64 0.257 . . . . 0.0 111.467 -178.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.47 -10.4 37.96 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.401 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 28.6 m-70 -97.86 -65.9 0.93 Allowed 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.62 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.9 mp -80.03 149.29 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.295 178.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.36 172.68 12.35 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.933 -179.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.529 ' C ' HD12 ' A' ' 44' ' ' ILE . 20.0 t30 -112.72 112.27 23.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.219 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.808 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.1 mp -111.85 93.46 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-O 120.865 0.364 . . . . 0.0 110.805 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 38.3 t0 64.78 39.64 6.07 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.206 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.28 1.83 90.38 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.562 -0.828 . . . . 0.0 113.123 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 20.9 m -112.46 137.13 51.11 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 117.187 0.494 . . . . 0.0 111.004 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 66.3 mt -77.72 118.55 20.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.433 0.635 . . . . 0.0 112.326 -177.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.808 ' HB2' HD13 ' A' ' 44' ' ' ILE . 37.5 mttt -139.65 163.34 32.84 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.101 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.743 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.8 m-90 -87.1 121.71 29.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 111.637 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.447 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 38.5 tt0 -175.26 145.3 0.85 Allowed Pre-proline 0 N--CA 1.466 0.332 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.909 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.447 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 37.1 Cg_endo -65.25 71.26 0.28 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.267 1.978 . . . . 0.0 112.797 -179.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.405 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -162.48 133.19 4.84 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.47 179.064 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.16 112.4 18.47 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.247 0.546 . . . . 0.0 112.457 -177.634 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.473 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 49.3 p90 -51.56 -30.39 20.56 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.952 178.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.7 p -50.87 -17.36 0.55 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -62.07 -29.46 70.32 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.042 -0.263 . . . . 0.0 110.634 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.438 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -129.04 0.66 5.25 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.664 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.5 m -112.16 147.96 35.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.112 0.482 . . . . 0.0 112.06 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -141.71 157.39 45.11 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.24 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 63.49 44.89 5.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.105 0.479 . . . . 0.0 110.456 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.682 ' O ' HD22 ' A' ' 13' ' ' LEU . 70.7 m -68.51 137.0 54.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.663 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.62 152.6 41.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.822 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.471 ' CG1' HD13 ' A' ' 69' ' ' LEU . 58.3 mt -130.94 140.74 47.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.337 0.589 . . . . 0.0 111.628 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -137.78 109.48 7.07 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.652 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.89 -122.43 13.49 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.675 -178.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.492 ' HB3' HG21 ' A' ' 5' ' ' ILE . 22.4 p -101.78 -2.8 29.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 117.012 0.406 . . . . 0.0 112.085 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.43 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.5 t -102.54 137.3 31.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-O 120.957 0.408 . . . . 0.0 111.752 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.865 HD22 HD22 ' A' ' 37' ' ' LEU . 7.5 tp -100.89 124.08 46.04 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.349 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.448 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -114.24 125.5 53.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.111 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.7 t -151.58 153.59 34.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.794 0.331 . . . . 0.0 111.722 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.1 m -94.42 126.02 39.43 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.3 m -127.7 145.32 50.94 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -178.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -74.86 138.03 42.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.477 177.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 56.4 mtp180 -91.09 142.98 27.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.555 0.217 . . . . 0.0 110.532 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 62.7 m -52.1 -25.13 8.06 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.694 0.283 . . . . 0.0 111.554 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -84.13 1.57 43.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.387 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.42 135.83 7.21 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.839 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.06 -167.34 12.3 Favored Glycine 0 C--N 1.32 -0.335 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -131.99 141.49 49.29 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 117.329 0.564 . . . . 0.0 111.594 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -153.99 129.89 10.19 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.454 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.6 t -92.13 135.18 34.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.737 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.2 p -121.88 158.33 29.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.203 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 4.5 p -121.87 145.65 47.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.797 0.332 . . . . 0.0 111.104 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.712 HD11 ' CH2' ' A' ' 50' ' ' TRP . 13.2 tt -144.42 143.32 23.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.647 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -97.15 117.6 31.7 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.781 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.625 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 6.8 mt -99.4 -4.61 31.16 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -178.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.949 ' ND2' HG22 ' A' ' 5' ' ' ILE . 10.7 t-20 -44.82 -29.1 0.73 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -178.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.7 m -81.32 -41.67 21.73 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.743 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -70.58 -52.76 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -177.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.581 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.8 mp -83.33 147.59 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.913 0.387 . . . . 0.0 111.543 -179.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.419 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 31.3 tt0 -138.51 165.57 26.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.22 -179.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -105.96 99.53 9.11 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 121.183 0.516 . . . . 0.0 110.766 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 47.8 t -97.54 97.12 5.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.538 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.585 ' O ' HG22 ' A' ' 25' ' ' THR . 26.0 t0 53.19 33.29 14.95 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.763 0.282 . . . . 0.0 111.763 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.5 28.63 11.13 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.752 -0.737 . . . . 0.0 113.253 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.28 135.24 30.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.931 0.396 . . . . 0.0 110.971 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 79.2 mt -74.01 119.86 18.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.803 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -123.02 131.03 53.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.417 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.423 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 14.2 t80 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.147 -179.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.425 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 13.6 p90 . . . . . 0 N--CA 1.464 0.239 0 CA-C-O 120.673 0.273 . . . . 0.0 111.296 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.886 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.0 tp -63.04 -20.04 24.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.449 -179.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -77.64 -25.51 49.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.784 0.326 . . . . 0.0 110.552 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.0 p -118.4 16.66 13.87 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.849 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.3 m -134.13 155.7 49.61 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.99 0.424 . . . . 0.0 111.37 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.41 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.9 ptt180 -132.29 172.9 11.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.945 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.438 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.2 p-10 49.52 57.46 6.48 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.239 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.614 HG21 ' CD1' ' A' ' 5' ' ' ILE . 19.3 p -78.94 132.15 36.62 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.659 ' O ' HD12 ' A' ' 19' ' ' LEU . 8.3 pt20 -157.66 163.85 37.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.616 -179.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.676 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.21 136.52 37.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.037 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.9 143.63 47.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.134 179.039 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.15 -152.19 33.51 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 119.849 -1.167 . . . . 0.0 111.534 -178.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.47 -37.01 18.71 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -178.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.1 p -141.25 35.65 1.7 Allowed 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.0 OUTLIER -115.69 146.74 41.59 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.156 0.503 . . . . 0.0 111.833 178.873 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.823 ' CB ' HD11 ' A' ' 37' ' ' LEU . 13.3 tp -119.09 124.13 46.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.321 179.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.85 143.19 47.12 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.09 172.24 17.15 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.33 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -112.17 133.65 54.18 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 83.7 m -130.97 134.56 46.84 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.2 ptpt -67.03 136.02 54.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.241 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.498 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.8 p -85.77 -177.81 6.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.272 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.8 mmp_? -61.26 -29.32 69.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.87 0.366 . . . . 0.0 110.794 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.44 8.72 8.71 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 66.56 36.35 4.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.262 0.553 . . . . 0.0 111.037 -178.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.419 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 25.2 mt-30 -118.53 136.93 53.55 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.862 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -93.06 124.76 37.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.909 0.385 . . . . 0.0 111.702 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.44 HG22 HG23 ' A' ' 25' ' ' THR . 4.2 m -129.98 149.72 33.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.619 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.2 p -71.02 135.06 47.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.185 0.517 . . . . 0.0 111.88 -178.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.9 t -142.51 161.42 38.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.253 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -142.35 156.72 45.26 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.394 0.616 . . . . 0.0 112.371 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.582 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -139.52 125.18 21.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.087 179.335 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -87.66 120.35 28.89 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.663 0.268 . . . . 0.0 111.289 -178.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.823 HD11 ' CB ' ' A' ' 19' ' ' LEU . 4.2 mp -88.35 -15.29 36.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.825 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.428 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.6 p-10 -57.51 -43.36 84.19 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 5.1 p30 -92.48 -10.58 37.31 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 122.077 -0.389 . . . . 0.0 111.848 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -99.51 -63.33 1.13 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.62 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.5 mp -79.64 147.16 6.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.791 178.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.42 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.41 170.05 16.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.654 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.53 ' C ' HD12 ' A' ' 44' ' ' ILE . 27.1 t30 -113.21 111.79 22.66 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.292 -179.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.792 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.3 mp -112.37 89.56 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.529 179.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.3 t70 68.52 38.81 2.27 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.042 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.95 0.83 90.52 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.624 -0.798 . . . . 0.0 113.426 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.8 m -108.72 135.33 50.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 117.334 0.567 . . . . 0.0 110.507 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.456 HD22 HG21 ' A' ' 41' ' ' ILE . 20.0 mt -77.49 117.0 18.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.65 0.738 . . . . 0.0 111.693 -177.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.792 ' HB2' HD13 ' A' ' 44' ' ' ILE . 10.3 mttm -138.3 163.26 32.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.577 179.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.702 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.1 m-90 -88.03 122.4 31.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.856 0.36 . . . . 0.0 111.791 -179.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.455 ' CG ' ' O ' ' A' ' 50' ' ' TRP . 26.4 mt-30 -171.16 149.81 2.73 Favored Pre-proline 0 N--CA 1.47 0.53 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.65 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -69.74 66.48 1.76 Allowed 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 121.831 1.687 . . . . 0.0 112.035 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.7 134.57 9.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.967 -1.015 . . . . 0.0 108.732 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -81.54 109.88 16.41 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -178.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.437 ' CD1' HG22 ' A' ' 41' ' ' ILE . 38.4 p90 -48.45 -29.73 4.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.576 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.2 p -48.36 -19.36 0.3 Allowed 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -62.46 -24.82 67.65 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.499 -178.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.446 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -133.3 2.4 3.55 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.4 m -112.58 148.53 34.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.13 0.49 . . . . 0.0 112.318 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -139.97 155.51 47.09 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.942 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 64.19 49.63 2.59 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.953 0.406 . . . . 0.0 111.103 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.676 ' O ' HD22 ' A' ' 13' ' ' LEU . 44.9 m -71.34 135.2 47.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.788 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.505 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.85 151.93 41.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.507 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.462 ' CG1' HD13 ' A' ' 69' ' ' LEU . 38.1 mt -129.94 140.49 48.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.27 0.557 . . . . 0.0 111.848 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -136.6 110.63 8.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.507 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.32 -121.87 16.71 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.224 -0.989 . . . . 0.0 110.887 -178.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.424 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.6 p -101.54 -3.21 28.9 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.581 HG13 ' O ' ' A' ' 85' ' ' ILE . 9.0 t -102.86 140.7 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 120.985 0.421 . . . . 0.0 111.814 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.807 HD22 HD22 ' A' ' 37' ' ' LEU . 9.2 tp -102.85 126.79 50.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.498 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.418 ' N ' HD12 ' A' ' 69' ' ' LEU . 5.6 m -115.21 124.23 50.87 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 t -151.78 153.64 34.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.742 0.306 . . . . 0.0 111.288 -178.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.8 m -94.42 125.7 39.23 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 75.2 m -126.16 143.41 51.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.435 0.636 . . . . 0.0 112.514 -178.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -75.7 139.53 41.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.89 178.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 47.8 mtp85 -93.55 144.63 25.19 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.754 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.6 m -51.85 -28.39 15.76 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.786 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -83.15 1.98 37.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.497 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.2 136.69 7.48 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.778 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.7 -170.78 13.51 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -131.22 141.85 50.09 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.238 0.519 . . . . 0.0 111.121 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 41.0 t30 -154.14 129.49 9.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.347 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.2 t -92.72 134.78 34.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.714 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.4 p -121.83 158.48 28.82 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.546 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 46.0 m -121.9 143.96 49.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.359 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.699 HD11 ' CH2' ' A' ' 50' ' ' TRP . 12.6 tt -145.11 143.08 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.843 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -96.97 116.26 28.88 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.035 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.61 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 9.8 mt -97.44 -6.83 33.04 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.886 ' ND2' HG22 ' A' ' 5' ' ' ILE . 7.4 t-20 -45.1 -27.53 0.6 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -178.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 61.7 m -81.88 -41.15 21.37 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.702 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.9 m -71.65 -51.18 34.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -178.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.618 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.8 mp -82.8 147.51 5.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.965 0.412 . . . . 0.0 111.182 -179.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -138.38 166.58 23.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.04 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -107.64 99.77 9.23 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.074 0.464 . . . . 0.0 110.629 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.5 t -98.36 97.11 5.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.868 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.498 ' O ' HG22 ' A' ' 25' ' ' THR . 34.2 t0 52.83 33.2 13.75 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.24 28.72 11.2 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.581 -0.819 . . . . 0.0 113.371 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 54.1 p -141.1 134.96 30.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.925 0.393 . . . . 0.0 111.289 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.427 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 41.1 mt -73.31 119.16 17.16 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.681 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.3 mttm -125.21 139.32 53.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.639 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 34.7 t80 . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.59 179.769 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.456 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 15.6 p90 . . . . . 0 N--CA 1.466 0.327 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.91 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.0 tp -61.77 -20.76 24.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.663 0.268 . . . . 0.0 111.618 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -75.92 -23.92 55.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.198 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.0 p -118.17 8.43 12.36 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 m -125.39 154.86 41.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.077 0.465 . . . . 0.0 111.226 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.2 173.18 11.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.814 -179.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.416 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.8 p-10 49.18 58.13 5.72 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.005 0.431 . . . . 0.0 112.152 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.609 HG21 ' CD1' ' A' ' 5' ' ' ILE . 9.9 p -79.57 131.98 36.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.784 178.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.742 ' O ' HD12 ' A' ' 19' ' ' LEU . 11.5 pt20 -157.45 163.72 38.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.448 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.745 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.37 136.72 37.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.841 -179.65 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.85 143.9 47.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.435 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.35 -151.01 36.49 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 119.927 -1.13 . . . . 0.0 111.522 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.28 -37.2 18.8 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.463 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.18 35.86 1.53 Allowed 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -114.36 149.99 35.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.02 0.438 . . . . 0.0 111.806 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.767 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.3 tp -123.56 124.22 42.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.546 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.42 144.31 47.01 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.865 0.364 . . . . 0.0 110.196 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.38 172.24 16.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.373 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -111.52 134.12 53.31 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 64.2 m -131.01 132.32 44.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.141 0.496 . . . . 0.0 112.103 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.433 ' HB3' ' CE2' ' A' ' 30' ' ' PHE . 1.9 ptpt -66.41 136.93 56.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.219 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.474 HG22 ' O ' ' A' ' 95' ' ' ASP . 82.6 p -85.86 -178.47 6.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.481 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 29.9 mtt180 -60.82 -30.06 69.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.766 0.317 . . . . 0.0 111.03 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.78 9.06 8.6 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 66.96 37.32 3.93 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.145 0.497 . . . . 0.0 111.635 -178.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 47.0 mt-30 -118.5 135.46 54.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.009 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.433 ' CE2' ' HB3' ' A' ' 24' ' ' LYS . 77.5 m-85 -92.34 124.61 36.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.994 0.426 . . . . 0.0 111.879 -178.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.6 m -129.88 148.24 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.295 179.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.4 t -70.14 136.49 50.18 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.305 0.574 . . . . 0.0 111.814 -178.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.7 t -143.14 161.53 37.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.994 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.3 ttpt -142.6 157.12 45.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.289 0.566 . . . . 0.0 111.901 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.462 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -138.6 127.13 29.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.29 179.592 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -87.68 117.02 26.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.629 0.252 . . . . 0.0 111.511 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.84 HD22 HD22 ' A' ' 69' ' ' LEU . 4.2 mp -86.11 -16.18 38.8 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.61 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -55.08 -48.03 74.09 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.886 -178.625 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.439 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.6 OUTLIER -92.08 -10.06 40.42 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 122.26 -0.275 . . . . 0.0 111.508 179.536 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.415 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 23.4 m-70 -96.5 -69.54 0.75 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.621 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.8 mp -79.34 151.36 4.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.137 178.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.421 ' HB1' ' OG ' ' A' ' 53' ' ' SER . . . -141.74 172.38 12.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.956 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.51 ' C ' HD12 ' A' ' 44' ' ' ILE . 23.2 t30 -112.82 113.1 25.04 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.971 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.887 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.6 mp -113.25 89.95 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.818 0.342 . . . . 0.0 111.327 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 39.6 t0 69.32 38.77 1.78 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.587 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.15 3.37 88.97 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 120.598 -0.81 . . . . 0.0 113.061 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 52.1 m -115.89 137.4 52.14 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.944 0.402 . . . . 0.0 111.124 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.9 mt -77.45 116.64 18.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.569 0.699 . . . . 0.0 111.925 -177.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.887 ' HB2' HD13 ' A' ' 44' ' ' ILE . 38.3 mttt -137.22 162.56 33.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.701 -1.136 . . . . 0.0 109.527 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.728 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 6.1 m-90 -87.67 124.1 33.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.103 0.478 . . . . 0.0 112.062 -179.063 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.441 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 12.6 tt0 -176.33 149.72 0.97 Allowed Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.179 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.441 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 12.3 Cg_exo -67.94 66.15 0.93 Allowed 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.27 1.98 . . . . 0.0 112.485 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.421 ' OG ' ' HB1' ' A' ' 42' ' ' ALA . 3.1 p -155.92 135.44 12.44 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.726 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.435 ' N ' ' ND2' ' A' ' 54' ' ' ASN . 0.0 OUTLIER -82.62 106.6 14.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.216 0.532 . . . . 0.0 112.313 -177.701 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.463 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 33.8 p90 -47.78 -30.18 3.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.532 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.6 p -49.35 -18.03 0.33 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.893 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -64.78 -26.93 68.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.569 0.223 . . . . 0.0 111.6 -178.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.487 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.3 p -128.68 -3.42 5.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.558 0.218 . . . . 0.0 111.485 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.8 m -109.2 148.96 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.207 0.527 . . . . 0.0 111.894 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.4 p90 -142.23 157.35 44.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.946 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.6 m-20 63.21 45.44 5.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.043 0.449 . . . . 0.0 110.75 -179.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.745 ' O ' HD22 ' A' ' 13' ' ' LEU . 21.4 m -69.25 137.08 52.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.604 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -141.38 151.17 43.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.489 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.542 HG21 HD13 ' A' ' 19' ' ' LEU . 24.3 mt -129.29 140.27 49.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.297 0.57 . . . . 0.0 111.823 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -136.77 108.92 7.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.238 -0.892 . . . . 0.0 108.98 179.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.75 -120.53 11.13 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.264 -0.97 . . . . 0.0 111.077 -178.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.438 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 20.6 p -103.33 -0.86 29.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.808 0.304 . . . . 0.0 111.514 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.492 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.7 t -103.61 139.11 25.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-O 120.934 0.397 . . . . 0.0 111.709 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.84 HD22 HD22 ' A' ' 37' ' ' LEU . 11.6 tp -103.94 124.9 49.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.345 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.3 m -114.86 125.22 53.41 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -152.13 153.88 34.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.625 0.25 . . . . 0.0 111.438 -178.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.4 m -94.26 125.8 39.11 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 96.1 m -123.87 142.38 51.17 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -73.7 137.31 43.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.873 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 18.7 mtm180 -91.45 142.39 27.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.694 0.283 . . . . 0.0 110.322 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.9 m -52.0 -28.99 18.87 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -83.73 3.82 31.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.656 0.265 . . . . 0.0 111.641 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.92 135.65 7.37 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.905 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.35 -171.95 14.0 Favored Glycine 0 C--N 1.319 -0.378 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -178.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -131.28 144.02 50.98 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 117.308 0.554 . . . . 0.0 111.263 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -154.2 129.53 9.77 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.302 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.6 t -92.54 134.88 34.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.74 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 81.3 p -122.35 158.07 30.43 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.317 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.9 m -122.9 144.06 49.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.871 0.367 . . . . 0.0 111.148 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.728 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.5 tt -145.65 143.99 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.895 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -97.58 116.3 29.52 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.798 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.636 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 6.0 mt -98.31 -6.64 30.53 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.91 ' ND2' HG22 ' A' ' 5' ' ' ILE . 6.8 t-20 -44.98 -27.98 0.61 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -178.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.0 t -81.93 -39.81 23.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.721 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -72.49 -52.08 25.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.553 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.53 147.64 5.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.007 0.432 . . . . 0.0 110.86 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 99' ' ' LYS . 10.9 tt0 -139.31 166.71 23.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.207 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -107.5 99.94 9.4 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.101 0.477 . . . . 0.0 110.662 -179.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.491 HG21 ' HG3' ' A' ' 99' ' ' LYS . 61.7 t -100.38 97.96 6.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.04 179.254 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.474 ' O ' HG22 ' A' ' 25' ' ' THR . 25.1 t0 53.53 32.03 13.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.656 0.265 . . . . 0.0 111.672 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.93 28.55 10.85 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.619 -0.801 . . . . 0.0 113.369 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 36.1 t -140.93 134.45 29.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.902 0.382 . . . . 0.0 111.193 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.41 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 42.9 mt -73.01 119.51 17.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.75 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.491 ' HG3' HG21 ' A' ' 94' ' ' VAL . 26.2 mmtt -122.99 132.17 54.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.072 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.415 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 13.2 t80 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.61 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.485 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 18.2 p90 . . . . . 0 N--CA 1.466 0.327 0 CA-C-O 120.527 0.203 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.981 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.3 tp -62.22 -22.31 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.778 0.323 . . . . 0.0 111.239 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -73.06 -24.43 60.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.832 0.349 . . . . 0.0 110.852 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.7 p -119.19 17.37 13.17 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.871 0.367 . . . . 0.0 111.723 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.9 m -133.21 155.28 49.63 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.0 0.428 . . . . 0.0 110.919 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.0 ptt85 -135.64 172.93 12.3 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.403 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.428 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.1 p-10 48.29 57.93 5.68 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.736 -0.666 . . . . 0.0 112.445 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.719 HG21 ' CD1' ' A' ' 5' ' ' ILE . 22.0 p -78.99 135.55 36.94 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.05 178.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.721 ' O ' HD12 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -158.91 163.52 36.48 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.039 0.447 . . . . 0.0 111.678 -179.407 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.734 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.61 136.5 37.91 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.807 179.897 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.9 143.14 48.11 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.407 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.61 -149.14 33.4 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 119.944 -1.122 . . . . 0.0 111.887 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -87.3 -37.77 16.87 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -177.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.8 p -141.62 36.36 1.64 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -115.93 149.64 38.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.257 0.551 . . . . 0.0 111.976 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.821 ' CB ' HD11 ' A' ' 37' ' ' LEU . 14.0 tp -123.49 123.79 41.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.768 178.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.91 142.68 47.07 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.64 172.78 15.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.523 -178.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -113.36 134.12 54.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.404 ' SG ' HD21 ' A' ' 98' ' ' LEU . 83.9 m -131.19 132.84 44.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.924 0.392 . . . . 0.0 111.82 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 5.2 ptpt -64.63 138.9 58.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.228 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.466 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.5 p -86.97 -176.87 5.9 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.506 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -61.02 -30.65 70.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.884 0.373 . . . . 0.0 111.277 -179.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.13 10.48 8.13 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -178.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 67.43 37.72 3.41 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.165 0.507 . . . . 0.0 111.216 -178.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -119.06 133.58 55.72 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.363 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.434 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 34.3 m-85 -91.3 125.42 36.06 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.115 0.483 . . . . 0.0 112.101 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.9 m -128.65 151.64 35.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.934 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.5 p -71.29 132.89 45.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.263 0.554 . . . . 0.0 111.784 -178.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.0 t -142.09 162.35 35.71 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.183 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.11 154.7 43.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.378 0.608 . . . . 0.0 111.85 -179.008 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.76 125.78 41.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 179.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -88.02 117.49 26.93 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.952 -178.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.821 HD11 ' CB ' ' A' ' 19' ' ' LEU . 3.4 mp -87.87 -15.87 35.53 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.0 p-10 -57.72 -44.86 86.28 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -177.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.434 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 3.5 m-20 -91.86 -9.97 41.42 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 122.047 -0.408 . . . . 0.0 111.247 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.436 ' CE1' ' HB2' ' A' ' 100' ' ' TYR . 14.3 m-70 -93.28 -63.55 1.2 Allowed 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.645 ' CD1' HD23 ' A' ' 37' ' ' LEU . 34.9 mt -83.05 154.03 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.965 178.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.59 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -142.0 171.89 13.44 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.257 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.604 ' C ' HD12 ' A' ' 44' ' ' ILE . 25.8 t30 -112.6 111.36 22.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.618 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.813 HD13 ' HB2' ' A' ' 49' ' ' LYS . 1.9 mp -111.7 88.56 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-O 121.05 0.452 . . . . 0.0 110.736 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 52.3 t0 67.91 39.39 2.58 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.16 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.1 2.68 90.56 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.741 -0.743 . . . . 0.0 113.348 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.6 m -109.92 136.38 49.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.199 0.499 . . . . 0.0 111.264 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.425 HD12 ' O ' ' A' ' 83' ' ' SER . 23.6 mt -77.1 116.29 17.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.701 0.762 . . . . 0.0 111.465 -178.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.813 ' HB2' HD13 ' A' ' 44' ' ' ILE . 41.3 mttt -139.43 163.52 32.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.684 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.799 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 9.5 m-90 -88.64 127.52 35.57 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.59 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.6 OUTLIER -174.46 151.96 1.65 Allowed Pre-proline 0 N--CA 1.469 0.519 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.539 -179.772 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.434 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 63.7 Cg_endo -74.12 66.17 5.2 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 121.945 1.763 . . . . 0.0 112.485 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -162.36 133.2 4.94 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.7 -1.136 . . . . 0.0 107.969 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.1 114.22 17.86 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -177.219 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 39.5 p90 -48.95 -29.24 4.56 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.386 177.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.6 p -49.83 -18.89 0.56 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.356 -178.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -60.8 -26.53 67.37 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.639 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.407 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.5 p -131.16 1.65 4.23 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.1 m -113.76 147.35 38.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.298 0.57 . . . . 0.0 112.481 -178.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.3 p90 -141.24 157.91 44.61 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.073 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 64.99 45.71 3.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.997 0.427 . . . . 0.0 111.39 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.734 ' O ' HD22 ' A' ' 13' ' ' LEU . 46.4 m -67.82 135.51 52.69 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.639 179.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.494 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.56 151.8 41.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.561 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.483 ' CG1' HD13 ' A' ' 69' ' ' LEU . 48.3 mt -130.15 139.75 50.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.315 0.579 . . . . 0.0 111.907 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -134.05 109.09 8.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.932 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 65.59 -119.37 13.77 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.215 -0.993 . . . . 0.0 111.205 -178.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 19.4 p -101.53 -5.59 24.97 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.6 t -101.03 138.27 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 120.872 0.368 . . . . 0.0 111.583 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.817 HD22 HD22 ' A' ' 37' ' ' LEU . 7.7 tp -101.12 125.7 47.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.138 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.483 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.0 m -115.07 125.55 53.66 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.8 t -151.4 153.16 34.17 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.331 -178.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.437 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.4 m -93.91 126.0 38.86 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 89.7 m -126.58 144.6 50.84 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -73.36 134.99 44.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.48 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.0 mtp85 -92.09 142.88 27.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.647 0.26 . . . . 0.0 110.654 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 33.1 m -51.54 -28.2 13.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.67 -178.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -82.11 1.87 34.01 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.538 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.81 133.72 6.53 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.997 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.3 -167.48 12.5 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -130.89 142.15 50.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.797 0.298 . . . . 0.0 111.178 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -154.74 130.79 10.23 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.685 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.437 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -93.82 134.46 36.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.102 0.477 . . . . 0.0 111.574 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.425 ' O ' HD12 ' A' ' 48' ' ' LEU . 24.3 p -120.67 158.93 26.36 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.636 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.3 p -123.92 145.85 48.86 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.859 0.361 . . . . 0.0 111.191 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.799 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.2 tt -144.89 143.33 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.637 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -96.92 116.93 30.05 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.419 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.621 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 6.9 mt -95.83 -4.71 43.28 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -178.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.981 ' ND2' HG22 ' A' ' 5' ' ' ILE . 11.9 t-20 -43.76 -29.31 0.51 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.3 m -81.77 -40.43 22.65 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.697 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.5 m -70.86 -53.17 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.579 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -83.13 145.29 8.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.281 0.562 . . . . 0.0 112.052 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.409 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 16.1 tt0 -135.75 165.49 25.47 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.942 -178.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -107.18 99.84 9.35 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.971 0.415 . . . . 0.0 111.141 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 25.7 t -99.53 99.34 8.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.798 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.466 ' O ' HG22 ' A' ' 25' ' ' THR . 28.9 t0 53.08 32.09 12.39 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.773 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.15 28.83 10.26 Favored Glycine 0 C--N 1.329 0.144 0 C-N-CA 120.579 -0.82 . . . . 0.0 113.149 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 t -141.01 135.95 31.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.864 0.364 . . . . 0.0 111.029 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.409 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 67.5 mt -74.6 121.3 21.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.0 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -127.24 137.21 52.83 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-O 121.065 0.46 . . . . 0.0 112.202 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.436 ' HB2' ' CE1' ' A' ' 40' ' ' HIS . 35.8 t80 . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.686 179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.453 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 23.1 p90 . . . . . 0 N--CA 1.464 0.266 0 CA-C-O 120.48 0.181 . . . . 0.0 111.312 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.953 HG22 ' ND2' ' A' ' 88' ' ' ASN . 7.3 tp -65.5 -15.68 19.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.696 0.284 . . . . 0.0 111.334 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -75.4 -25.24 57.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.764 0.316 . . . . 0.0 110.659 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.9 p -118.8 18.19 13.36 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.465 179.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.2 m -133.41 154.76 50.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.947 0.403 . . . . 0.0 111.441 -179.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -133.69 172.74 12.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.174 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 49.0 57.77 6.09 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.209 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.675 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.2 p -79.39 133.11 36.57 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.647 ' O ' HD12 ' A' ' 19' ' ' LEU . 18.5 pt20 -157.76 163.77 37.75 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.399 -178.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.739 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.35 135.4 39.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.574 179.748 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -118.9 143.54 46.94 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.195 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.69 -151.49 33.06 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 119.891 -1.147 . . . . 0.0 111.465 -178.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.64 -37.19 18.27 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.8 35.24 1.78 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.6 mp0 -115.91 146.96 41.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.017 0.437 . . . . 0.0 111.775 179.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.794 ' CB ' HD11 ' A' ' 37' ' ' LEU . 10.2 tp -119.75 124.91 47.35 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 178.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.89 143.58 47.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.922 0.392 . . . . 0.0 110.486 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.35 172.46 16.53 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.164 -178.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.33 133.88 54.18 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 177.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.6 m -130.54 133.16 46.01 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.255 0.55 . . . . 0.0 111.935 -178.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 4.5 ptpt -66.45 136.05 55.15 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.273 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 95' ' ' ASP . 69.2 p -85.29 -177.59 6.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.577 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.0 mmt85 -60.8 -29.7 69.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.681 0.276 . . . . 0.0 111.263 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.11 9.32 10.67 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 66.68 37.84 4.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.159 0.504 . . . . 0.0 111.528 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.422 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 67.6 mt-30 -117.22 135.83 53.51 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -92.42 125.16 36.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 111.836 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 m -130.37 151.19 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.819 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.8 m -72.1 134.19 45.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.194 0.521 . . . . 0.0 111.558 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.2 t -142.68 161.45 38.05 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.188 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -142.82 156.34 44.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.473 0.654 . . . . 0.0 112.276 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.514 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -136.47 124.42 34.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.468 179.127 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -87.75 119.55 28.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.717 0.294 . . . . 0.0 110.752 -178.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.805 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -88.84 -14.86 35.94 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.462 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 6.4 p-10 -56.04 -46.54 78.83 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.462 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.1 p30 -92.36 -10.0 39.78 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 122.081 -0.387 . . . . 0.0 111.564 179.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -96.33 -64.6 1.03 Allowed 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.576 HD13 ' CD1' ' A' ' 50' ' ' TRP . 33.0 mm -80.52 147.54 6.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.541 178.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.418 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.18 171.55 13.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.772 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.556 ' C ' HD12 ' A' ' 44' ' ' ILE . 22.7 t30 -113.18 112.53 23.94 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.033 -179.321 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.736 HD13 ' HB2' ' A' ' 49' ' ' LYS . 1.9 mp -110.61 89.4 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.726 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 52.7 t0 67.55 39.39 2.84 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.402 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.74 0.75 87.63 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.674 -0.774 . . . . 0.0 113.263 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.1 m -112.63 135.28 53.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.15 0.475 . . . . 0.0 110.632 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.1 mt -77.34 118.9 20.27 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.553 0.692 . . . . 0.0 111.305 -178.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.736 ' HB2' HD13 ' A' ' 44' ' ' ILE . 17.9 mttt -136.82 162.75 32.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.851 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.774 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.2 m-90 -85.54 119.83 26.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.941 0.4 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.417 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 29.8 tt0 -173.77 148.31 1.43 Allowed Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.28 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.417 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 13.0 Cg_exo -67.22 65.53 0.67 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.317 2.011 . . . . 0.0 112.833 -179.055 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.2 p -157.63 134.35 9.91 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.823 178.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.434 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.0 109.28 15.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.125 0.488 . . . . 0.0 112.059 -178.034 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.432 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 32.7 p90 -48.45 -29.09 3.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.532 178.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.8 p -48.65 -19.34 0.34 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.687 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -62.36 -25.25 67.81 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 121.066 -0.254 . . . . 0.0 111.271 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.451 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -133.82 3.4 3.49 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.2 m -115.36 149.49 37.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.269 0.557 . . . . 0.0 112.34 -178.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -143.03 157.81 44.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.782 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 64.28 46.19 3.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.903 0.383 . . . . 0.0 110.512 -178.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.739 ' O ' HD22 ' A' ' 13' ' ' LEU . 72.4 m -70.12 135.33 49.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.689 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.478 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.63 152.04 42.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.768 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.468 ' CG1' HD13 ' A' ' 69' ' ' LEU . 22.0 mt -129.71 140.18 49.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.305 0.574 . . . . 0.0 111.762 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -135.6 108.92 7.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.044 179.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.94 -120.99 13.18 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.081 -178.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.421 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.8 p -102.11 -3.93 26.73 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.416 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.5 t -101.83 139.95 21.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-O 120.902 0.382 . . . . 0.0 111.561 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.805 HD22 HD22 ' A' ' 37' ' ' LEU . 5.6 tp -104.08 128.88 51.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.854 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.631 ' N ' HD12 ' A' ' 69' ' ' LEU . 7.5 m -118.09 127.11 53.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.417 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -151.93 153.34 33.92 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.276 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.7 m -94.59 125.83 39.49 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 78.8 m -126.18 144.56 50.72 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.62 137.31 42.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.645 178.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.0 mtp85 -92.56 144.64 25.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.706 0.289 . . . . 0.0 110.591 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.3 m -51.87 -28.06 14.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.7 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -83.43 1.95 39.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.667 0.27 . . . . 0.0 111.554 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.29 136.97 7.17 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.655 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.39 -171.27 13.69 Favored Glycine 0 C--N 1.32 -0.352 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -130.06 141.12 50.75 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.296 0.548 . . . . 0.0 111.212 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -153.93 130.67 10.8 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.232 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.2 t -93.57 134.95 35.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.681 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 92.3 p -123.24 158.33 31.12 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.298 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.1 p -123.42 146.47 47.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.257 -179.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.716 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 14.1 tt -145.41 143.1 22.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.584 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -95.79 119.13 33.73 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.971 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.545 ' HB3' HD12 ' A' ' 91' ' ' ILE . 10.9 mt -99.26 -5.65 29.46 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -178.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.953 ' ND2' HG22 ' A' ' 5' ' ' ILE . 12.4 t-20 -44.75 -28.2 0.6 Allowed 'General case' 0 N--CA 1.467 0.404 0 O-C-N 122.081 -0.387 . . . . 0.0 111.982 -178.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.0 t -82.35 -40.06 21.91 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.774 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -72.4 -53.0 20.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -178.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.654 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -83.41 147.44 5.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.017 0.437 . . . . 0.0 111.339 -179.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 99' ' ' LYS . 11.9 tt0 -138.33 165.86 25.68 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.974 -178.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -108.45 100.13 9.44 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.156 0.503 . . . . 0.0 110.586 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.9 t -98.97 98.59 7.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.072 179.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.432 ' O ' HG22 ' A' ' 25' ' ' THR . 26.2 t0 53.06 33.74 15.62 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 111.752 0.278 . . . . 0.0 111.752 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.46 28.56 12.59 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.344 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.8 m -140.68 136.07 32.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.861 0.362 . . . . 0.0 111.296 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.42 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 59.3 mt -74.39 119.25 18.34 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.5 mmtt -125.17 138.23 54.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.374 -179.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.453 ' CE1' ' HB ' ' A' ' 90' ' ' VAL . 89.0 t80 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.344 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.446 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 30.1 p90 . . . . . 0 N--CA 1.463 0.182 0 N-CA-C 111.648 0.24 . . . . 0.0 111.648 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.891 HG22 ' ND2' ' A' ' 88' ' ' ASN . 7.5 tp -63.49 -17.29 19.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.912 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.76 -26.82 57.75 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.943 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.9 p -118.96 20.8 12.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.283 179.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 65.7 m -136.34 154.74 50.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.033 0.444 . . . . 0.0 111.407 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 ptm85 -133.78 173.16 11.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.192 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 48.85 57.82 5.99 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.072 -0.513 . . . . 0.0 112.106 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.616 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.1 p -79.06 131.96 36.44 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 178.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.746 ' O ' HD12 ' A' ' 19' ' ' LEU . 6.4 pt20 -157.56 164.02 37.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.892 0.377 . . . . 0.0 111.743 -178.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.711 HD22 ' O ' ' A' ' 62' ' ' SER . 0.9 OUTLIER -97.41 136.01 38.47 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.056 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.11 143.84 47.95 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.63 -151.78 32.21 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 119.797 -1.192 . . . . 0.0 111.608 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.0 -37.5 18.9 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -178.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -142.12 36.56 1.55 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -115.51 147.29 40.83 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.985 0.421 . . . . 0.0 111.704 178.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.781 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.0 tp -120.55 123.66 43.42 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.646 ' HB2' ' HE2' ' A' ' 34' ' ' LYS . . . -118.55 143.85 46.47 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.4 172.74 15.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.522 -178.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -112.34 133.55 54.38 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 177.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 84.5 m -130.8 133.97 46.44 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 8.5 ptpt -66.51 134.86 53.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.011 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.527 HG22 ' O ' ' A' ' 95' ' ' ASP . 70.8 p -84.05 -176.2 6.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.504 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.25 -30.5 70.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.753 0.311 . . . . 0.0 111.036 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.64 10.04 8.28 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 66.89 37.77 3.9 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.151 0.5 . . . . 0.0 111.778 -179.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.431 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 66.6 mt-30 -120.32 135.19 55.1 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.015 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.434 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 30.4 m-85 -92.93 125.09 37.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.136 0.493 . . . . 0.0 111.708 -178.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 22.9 m -128.25 153.08 37.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.607 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.7 m -72.65 134.37 45.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.144 0.497 . . . . 0.0 111.807 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.5 t -144.38 161.55 38.72 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.349 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.646 ' HE2' ' HB2' ' A' ' 20' ' ' ALA . 12.1 ttmt -144.29 156.47 44.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.21 0.529 . . . . 0.0 111.895 -179.157 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.422 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.3 tp -134.91 129.76 51.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.027 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -88.98 115.48 26.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.63 0.252 . . . . 0.0 111.48 -178.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.878 HD22 HD22 ' A' ' 69' ' ' LEU . 4.0 mp -87.0 -14.99 40.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.511 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -46.18 79.2 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -178.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -92.23 -10.0 40.15 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -96.7 -64.93 1.0 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.548 HD11 HD22 ' A' ' 87' ' ' LEU . 21.1 mm -79.86 146.03 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.537 178.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -137.82 171.34 14.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.804 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.426 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 28.9 t30 -111.4 108.01 17.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.618 -179.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.5 mm -108.65 89.06 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.645 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 54.8 t0 66.13 39.0 4.47 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.305 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.14 0.47 89.58 Favored Glycine 0 CA--C 1.519 0.32 0 C-N-CA 120.872 -0.68 . . . . 0.0 113.32 179.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 52.6 m -110.16 136.36 49.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.077 0.439 . . . . 0.0 110.78 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.2 mt -77.23 117.52 18.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.639 0.733 . . . . 0.0 111.359 -178.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -137.57 162.54 33.5 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 114.706 -1.134 . . . . 0.0 110.354 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.731 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.9 m-90 -86.91 119.3 26.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.992 0.425 . . . . 0.0 111.072 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.42 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 32.4 tt0 -173.05 143.24 1.08 Allowed Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.658 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 32.0 Cg_endo -64.72 72.59 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.019 1.812 . . . . 0.0 112.544 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.2 p -162.85 136.01 5.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.87 -1.059 . . . . 0.0 108.882 179.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -83.01 109.88 17.48 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.423 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 29.4 p90 -49.95 -30.31 10.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.919 178.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.1 p -49.17 -18.58 0.35 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -63.22 -25.49 68.36 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.853 -0.339 . . . . 0.0 111.455 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.426 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.8 p -131.5 -0.64 3.96 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.545 179.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.3 m -109.72 148.62 31.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.113 0.482 . . . . 0.0 112.016 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -142.4 157.38 44.84 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.684 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 21.5 m120 63.38 45.08 5.07 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.61 -179.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.711 ' O ' HD22 ' A' ' 13' ' ' LEU . 67.6 m -68.0 137.37 55.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.56 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.88 152.44 42.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.801 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.534 HG21 HD13 ' A' ' 19' ' ' LEU . 35.4 mt -130.93 139.29 51.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.291 0.567 . . . . 0.0 111.932 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -136.86 110.32 7.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.82 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.73 -121.54 12.53 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.466 -0.874 . . . . 0.0 111.202 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.422 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.8 p -101.61 -4.32 26.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.603 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.1 t -101.54 141.12 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.878 HD22 HD22 ' A' ' 37' ' ' LEU . 9.3 tp -102.71 123.53 46.57 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.439 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.402 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.3 m -114.46 124.4 51.83 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.3 t -152.15 153.8 34.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.63 0.252 . . . . 0.0 111.399 -178.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 16.3 m -94.85 126.56 40.25 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 87.9 m -125.86 145.49 50.22 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -75.06 136.45 41.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.261 177.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 45.3 mtp180 -93.07 144.47 25.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.714 0.292 . . . . 0.0 110.944 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 46.8 m -52.21 -25.87 10.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.641 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -82.36 0.28 42.54 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.76 0.314 . . . . 0.0 111.174 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.45 135.38 7.03 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.89 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 113.83 -166.04 12.11 Favored Glycine 0 C--N 1.319 -0.378 0 N-CA-C 111.447 -0.661 . . . . 0.0 111.447 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -131.41 143.82 50.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 117.148 0.474 . . . . 0.0 111.295 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -154.25 130.79 10.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.267 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.0 t -94.31 134.88 36.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.664 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.6 p -123.27 158.41 31.01 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.662 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.7 p -122.64 146.63 47.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.849 0.357 . . . . 0.0 111.174 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.674 HD11 ' CH2' ' A' ' 50' ' ' TRP . 12.9 tt -145.81 143.2 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.803 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -97.1 117.29 30.97 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.853 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.651 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 11.1 mt -98.78 -4.62 32.94 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -178.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.891 ' ND2' HG22 ' A' ' 5' ' ' ILE . 10.6 t-20 -44.77 -27.25 0.48 Allowed 'General case' 0 N--CA 1.469 0.515 0 O-C-N 122.0 -0.438 . . . . 0.0 112.101 -178.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.1 t -81.77 -41.94 20.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.731 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.0 m -70.72 -52.45 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -177.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.651 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -83.43 147.1 6.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 120.941 0.401 . . . . 0.0 111.58 -178.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 36.1 tt0 -137.71 164.29 29.23 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.886 -178.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -106.04 99.69 9.27 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-O 121.195 0.522 . . . . 0.0 110.697 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -98.05 97.56 6.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.29 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.527 ' O ' HG22 ' A' ' 25' ' ' THR . 30.8 t0 52.46 32.29 11.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.61 0.243 . . . . 0.0 111.617 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.38 28.42 10.61 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.823 -0.703 . . . . 0.0 113.429 179.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.8 t -142.07 136.24 29.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.833 0.349 . . . . 0.0 111.463 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.466 HD22 HG21 ' A' ' 91' ' ' ILE . 78.9 mt -74.35 120.51 20.02 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.718 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 17.3 mttt -126.35 145.76 50.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.949 -178.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 53.3 t80 . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.103 179.874 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 25.5 p90 . . . . . 0 N--CA 1.464 0.241 0 CA-C-O 120.63 0.253 . . . . 0.0 111.409 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.967 HG22 ' ND2' ' A' ' 88' ' ' ASN . 5.1 tp -66.4 -14.6 17.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.713 0.292 . . . . 0.0 111.447 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -77.29 -27.52 53.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 0.0 110.683 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.9 p -118.68 19.11 13.3 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.258 179.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.6 m -133.1 154.48 50.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.04 0.448 . . . . 0.0 111.374 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.59 172.41 12.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.964 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 p30 49.4 57.68 6.23 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.704 HG21 ' CD1' ' A' ' 5' ' ' ILE . 40.4 p -79.85 133.17 36.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 177.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.809 ' O ' HD12 ' A' ' 19' ' ' LEU . 8.5 pt20 -158.56 163.89 36.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.592 -179.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.703 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.56 136.47 37.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.268 0.556 . . . . 0.0 111.167 -179.745 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.22 143.26 48.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.282 179.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.14 -150.31 37.0 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 119.884 -1.15 . . . . 0.0 111.565 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -86.29 -37.12 18.87 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -178.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.19 35.33 1.52 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -114.67 149.65 36.4 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.986 0.422 . . . . 0.0 111.679 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.809 HD12 ' O ' ' A' ' 12' ' ' GLN . 14.2 tp -122.87 123.89 42.0 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.35 143.12 47.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.877 0.37 . . . . 0.0 110.212 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.82 172.86 15.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.255 -178.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -109.36 135.08 51.0 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.6 m -130.61 131.86 45.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.154 0.502 . . . . 0.0 111.415 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 0.4 OUTLIER -66.03 137.06 56.83 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.459 -179.491 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.8 p -86.52 -178.15 6.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.481 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.3 mmt180 -60.38 -29.05 68.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.714 0.293 . . . . 0.0 111.247 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.85 9.18 10.44 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -178.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 66.77 37.29 4.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.119 0.485 . . . . 0.0 111.393 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.467 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 27.3 mm-40 -118.18 137.81 52.74 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 177.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -93.15 125.04 37.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.946 0.403 . . . . 0.0 111.548 -178.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.414 HG22 HG23 ' A' ' 25' ' ' THR . 2.4 m -128.42 150.08 33.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.733 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 20.5 t -70.92 133.65 46.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.076 0.465 . . . . 0.0 111.41 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.7 t -144.59 161.53 38.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.464 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -143.1 157.91 44.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.396 0.617 . . . . 0.0 112.049 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.433 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.1 tp -137.08 128.56 42.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.142 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -88.23 116.78 26.67 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.949 HD22 HD22 ' A' ' 69' ' ' LEU . 4.6 mp -86.27 -14.44 43.72 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.544 178.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.406 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -56.19 -48.91 75.44 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.251 0.464 . . . . 0.0 112.251 -178.461 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.83 -10.48 39.63 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 122.014 -0.429 . . . . 0.0 111.56 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.427 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 32.2 m-70 -96.07 -64.5 1.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.588 HD12 ' N ' ' A' ' 41' ' ' ILE . 2.1 mp -80.26 148.51 5.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.276 178.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.559 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -141.15 171.63 13.8 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.784 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.542 ' C ' HD12 ' A' ' 44' ' ' ILE . 25.0 t30 -113.19 112.29 23.53 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.324 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.835 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.5 mp -112.97 89.28 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.141 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t0 68.43 37.02 2.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.252 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.95 0.28 87.43 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.425 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.3 m -109.81 135.02 51.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 117.254 0.527 . . . . 0.0 110.729 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.7 mt -77.31 116.56 18.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.838 0.828 . . . . 0.0 111.335 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.835 ' HB2' HD13 ' A' ' 44' ' ' ILE . 61.0 mttt -139.42 163.57 32.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.109 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.704 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.5 m-90 -87.83 127.82 35.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.091 0.472 . . . . 0.0 112.246 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.559 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 1.5 mt-30 -172.57 152.21 2.54 Favored Pre-proline 0 N--CA 1.467 0.385 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.896 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.3 62.21 2.68 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 121.86 1.707 . . . . 0.0 112.029 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.51 135.34 10.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.633 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.403 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.77 110.99 16.8 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -177.852 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.466 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 39.5 p90 -48.32 -29.63 4.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.512 178.264 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.0 p -49.02 -17.82 0.24 Allowed 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -179.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -63.01 -28.67 70.26 Favored 'General case' 0 C--N 1.332 -0.166 0 O-C-N 122.163 -0.336 . . . . 0.0 111.141 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.45 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -128.56 -0.05 5.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.522 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.3 m -111.47 148.73 32.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.316 0.579 . . . . 0.0 112.395 -178.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -143.3 157.86 44.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.132 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 63.64 45.34 4.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.013 0.435 . . . . 0.0 110.887 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.703 ' O ' HD22 ' A' ' 13' ' ' LEU . 74.9 m -70.33 137.26 50.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.828 179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.77 151.65 41.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.4 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.556 HG21 HD13 ' A' ' 19' ' ' LEU . 57.5 mt -130.58 141.18 46.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.353 0.597 . . . . 0.0 112.094 -179.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -137.0 109.05 7.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.318 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.412 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.38 -119.93 12.35 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.446 -0.883 . . . . 0.0 111.689 -178.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.45 ' HB3' HG21 ' A' ' 5' ' ' ILE . 25.8 p -100.69 -4.71 27.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.592 HG13 ' O ' ' A' ' 85' ' ' ILE . 11.0 t -103.18 140.59 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-O 121.041 0.448 . . . . 0.0 112.208 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.949 HD22 HD22 ' A' ' 37' ' ' LEU . 8.0 tp -103.37 126.93 50.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.516 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.483 ' N ' HD12 ' A' ' 69' ' ' LEU . 31.8 m -115.71 125.54 52.95 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 t -151.57 153.43 34.51 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.297 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 6.2 m -95.02 126.0 40.06 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.6 m -126.44 145.18 50.58 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -74.77 137.3 41.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.954 178.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 49.2 mtm180 -91.93 144.49 25.41 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.348 179.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.4 m -51.98 -27.03 11.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.579 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -82.85 1.55 38.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.354 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.96 137.82 7.4 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.314 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.75 -168.16 12.49 Favored Glycine 0 C--N 1.319 -0.386 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -178.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -133.7 143.32 48.44 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 117.379 0.59 . . . . 0.0 111.431 -179.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -154.14 131.28 11.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.185 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -93.48 134.46 35.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.612 -179.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.6 p -121.73 158.09 29.52 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.189 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 78.7 p -122.74 144.34 49.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.383 . . . . 0.0 111.136 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.687 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.8 tt -145.13 142.93 22.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.64 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -96.86 116.18 28.72 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.401 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.632 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 3.6 mt -96.71 -4.3 41.01 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -178.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.967 ' ND2' HG22 ' A' ' 5' ' ' ILE . 11.9 t-20 -44.45 -26.91 0.39 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.0 m -81.86 -40.98 21.65 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.704 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.8 m -72.98 -52.64 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 113.485 0.921 . . . . 0.0 113.485 -177.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.519 ' N ' HG23 ' A' ' 90' ' ' VAL . 2.7 mp -81.83 147.57 6.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.042 0.448 . . . . 0.0 111.319 -179.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 20.0 tt0 -139.88 166.19 25.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.013 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -106.8 99.61 9.17 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-O 121.207 0.527 . . . . 0.0 110.349 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.8 t -98.46 98.0 6.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.616 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.489 ' O ' HG22 ' A' ' 25' ' ' THR . 31.7 t0 53.57 33.23 15.86 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.93 28.41 12.11 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.766 -0.731 . . . . 0.0 113.79 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.6 m -141.38 137.89 32.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.907 0.384 . . . . 0.0 111.108 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.433 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 67.8 mt -73.91 119.66 18.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.365 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 16.3 mttt -123.92 139.27 54.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.844 -178.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.427 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 20.3 t80 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.233 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.477 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 19.2 p90 . . . . . 0 N--CA 1.464 0.264 0 CA-C-O 120.641 0.257 . . . . 0.0 111.359 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.94 HG22 ' ND2' ' A' ' 88' ' ' ASN . 5.2 tp -68.12 -10.43 12.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 120.705 0.288 . . . . 0.0 111.469 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -77.28 -25.88 51.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.842 0.353 . . . . 0.0 110.798 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.3 p -118.31 -2.35 11.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.75 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.2 m -110.51 152.71 26.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.123 0.487 . . . . 0.0 111.143 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.406 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 1.2 ptm180 -132.87 172.84 12.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.606 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.408 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.4 p-10 50.13 56.97 7.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.951 0.405 . . . . 0.0 112.017 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.683 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.3 p -79.52 132.72 36.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.998 178.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.828 ' O ' HD12 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -157.19 163.3 39.0 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.281 -179.515 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.722 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.56 136.1 38.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.789 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.421 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.58 145.65 47.14 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.027 179.176 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.67 -153.4 29.11 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 119.731 -1.224 . . . . 0.0 111.196 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.2 -36.85 19.21 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.22 35.94 1.9 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 15.3 mp0 -116.67 147.66 41.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.088 0.471 . . . . 0.0 111.737 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.828 HD12 ' O ' ' A' ' 12' ' ' GLN . 13.6 tp -121.75 125.55 46.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.536 -0.756 . . . . 0.0 108.988 178.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.04 142.69 47.12 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.867 0.365 . . . . 0.0 110.104 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.11 172.17 17.25 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.118 -178.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -114.33 134.77 54.72 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 177.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 59.3 m -130.49 133.32 46.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.148 0.499 . . . . 0.0 111.693 -178.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 1.3 pttt -66.47 136.06 55.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.335 -179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 95' ' ' ASP . 46.0 p -84.51 -176.98 6.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.503 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.2 mmt180 -62.33 -29.79 70.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.145 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.74 9.78 7.29 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 66.77 37.29 4.24 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.144 0.497 . . . . 0.0 111.397 -178.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.477 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 28.2 mt-30 -118.51 137.47 53.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.088 178.241 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -94.23 126.5 39.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.898 0.38 . . . . 0.0 111.625 -178.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 25.6 m -131.04 153.0 38.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.051 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.9 m -73.16 134.11 44.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.12 0.486 . . . . 0.0 111.547 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.0 t -144.59 161.48 39.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.062 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.6 ttpt -141.4 156.84 45.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.454 0.645 . . . . 0.0 112.234 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.475 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -136.83 123.76 30.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 114.899 -1.046 . . . . 0.0 108.566 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -86.8 118.75 26.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.693 0.282 . . . . 0.0 110.673 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.798 HD11 ' CB ' ' A' ' 19' ' ' LEU . 4.3 mp -86.95 -14.98 40.22 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.491 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.1 p-10 -57.28 -43.73 83.36 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.1 p30 -91.8 -10.06 41.24 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 122.247 -0.283 . . . . 0.0 111.433 179.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.406 ' CE1' ' CB ' ' A' ' 100' ' ' TYR . 46.7 m-70 -99.84 -64.19 1.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.614 HD11 HD22 ' A' ' 87' ' ' LEU . 26.0 mm -78.64 146.97 7.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.53 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.63 ' HB1' ' OG ' ' A' ' 53' ' ' SER . . . -139.56 172.01 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.611 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.496 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 26.7 t30 -112.74 108.25 17.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.824 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.2 mm -109.18 89.54 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.03 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.7 t70 68.3 39.54 2.27 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.138 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.3 0.71 90.04 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.903 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.8 m -110.61 137.2 48.6 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.845 0.355 . . . . 0.0 110.762 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.491 HD12 ' OG ' ' A' ' 83' ' ' SER . 11.5 mt -77.21 116.78 18.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.609 0.718 . . . . 0.0 111.281 -178.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -135.49 162.09 33.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.805 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.741 ' CE2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -86.21 121.55 28.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.993 0.425 . . . . 0.0 111.476 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.452 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 40.5 tt0 -174.17 150.36 1.56 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.38 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.452 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 7.3 Cg_exo -70.42 65.64 2.18 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.237 1.958 . . . . 0.0 112.369 -179.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.63 ' OG ' ' HB1' ' A' ' 42' ' ' ALA . 24.6 p -157.45 134.72 10.36 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.394 178.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.436 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.36 108.12 14.71 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -177.557 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.456 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 40.9 p90 -47.67 -30.69 3.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.22 178.267 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.6 p -47.26 -18.4 0.1 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.853 -179.459 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -65.08 -27.06 68.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.614 0.245 . . . . 0.0 111.535 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.496 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.5 p -129.22 -1.4 5.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.451 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -111.69 149.62 31.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.184 0.516 . . . . 0.0 111.916 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -142.19 157.58 44.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.735 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.4 m120 64.13 48.7 2.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.981 0.419 . . . . 0.0 110.657 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.722 ' O ' HD22 ' A' ' 13' ' ' LEU . 62.8 m -71.37 134.27 46.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.555 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.468 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -141.78 151.84 43.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.561 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.507 HG21 HD13 ' A' ' 19' ' ' LEU . 34.6 mt -130.4 141.52 46.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-O 121.353 0.597 . . . . 0.0 112.185 -179.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -137.74 109.0 6.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.887 178.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.17 -121.83 12.07 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.464 -0.874 . . . . 0.0 111.332 -178.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.42 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 31.2 p -102.47 -2.69 28.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.0 t -102.36 139.32 23.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.952 0.406 . . . . 0.0 111.592 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.792 HD22 HD22 ' A' ' 37' ' ' LEU . 6.3 tp -102.35 128.2 49.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.628 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.62 ' N ' HD12 ' A' ' 69' ' ' LEU . 4.2 m -116.8 123.92 48.29 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.1 t -151.63 153.28 34.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.608 0.242 . . . . 0.0 111.21 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.6 m -94.83 126.15 39.96 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.543 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.403 ' HB3' ' OD1' ' A' ' 43' ' ' ASN . 81.4 m -125.59 144.32 50.63 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -74.52 136.98 42.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.587 178.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -92.53 142.32 27.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.717 0.294 . . . . 0.0 110.583 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.1 m -52.13 -26.26 10.86 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.619 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -83.18 1.36 40.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.659 0.266 . . . . 0.0 111.532 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.13 133.42 6.53 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.804 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.83 -169.02 12.8 Favored Glycine 0 C--N 1.317 -0.483 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 -178.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -132.26 144.03 50.32 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 117.238 0.519 . . . . 0.0 111.413 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -154.11 129.98 10.17 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.558 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.4 t -91.82 134.67 34.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.41 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.491 ' OG ' HD12 ' A' ' 48' ' ' LEU . 29.7 p -123.42 158.04 32.06 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.402 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.0 m -122.45 145.53 48.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.02 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.677 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.9 tt -144.78 143.37 22.74 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.725 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -96.43 116.18 28.64 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.103 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.614 HD22 HD11 ' A' ' 41' ' ' ILE . 11.6 mt -96.95 -6.99 34.28 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -179.117 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.94 ' ND2' HG22 ' A' ' 5' ' ' ILE . 13.2 t-20 -44.86 -28.19 0.62 Allowed 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -178.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.4 m -81.98 -38.23 25.46 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.741 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.9 m -74.4 -53.46 17.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -178.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.611 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.2 147.63 5.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.06 0.457 . . . . 0.0 111.268 -178.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 9.9 tt0 -137.32 166.54 23.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.157 -178.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -107.21 99.42 8.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.121 0.486 . . . . 0.0 110.184 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.1 t -98.28 96.08 4.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.196 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.514 ' O ' HG22 ' A' ' 25' ' ' THR . 28.3 t0 53.09 33.47 15.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.655 0.264 . . . . 0.0 111.466 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.59 28.65 12.17 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.269 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 62.5 p -140.92 133.76 29.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.802 0.334 . . . . 0.0 110.912 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.437 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 77.4 mt -74.49 121.07 20.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.732 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.458 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 8.5 mttm -125.11 137.0 54.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.076 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.406 ' CB ' ' CE1' ' A' ' 40' ' ' HIS . 39.1 t80 . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.649 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.454 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 14.1 p90 . . . . . 0 N--CA 1.464 0.266 0 N-CA-C 111.662 0.245 . . . . 0.0 111.662 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.892 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.0 tp -63.87 -19.33 24.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.633 0.254 . . . . 0.0 111.446 -179.33 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -75.45 -26.79 58.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.819 0.342 . . . . 0.0 110.855 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.7 p -118.66 13.95 13.43 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.537 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 71.1 m -127.11 153.6 45.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.037 0.446 . . . . 0.0 111.477 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -133.1 172.58 12.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.96 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.0 p30 49.62 57.66 6.27 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.713 HG21 ' CD1' ' A' ' 5' ' ' ILE . 31.3 p -79.65 134.15 36.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.015 178.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.7 ' O ' HD12 ' A' ' 19' ' ' LEU . 17.9 pt20 -158.86 163.84 36.26 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.132 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.745 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.39 136.22 38.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.177 0.513 . . . . 0.0 110.991 -179.779 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.74 145.01 46.93 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.381 179.097 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.62 -152.38 30.95 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.55 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -85.89 -37.14 19.45 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.11 35.54 1.54 Allowed 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 5.8 mp0 -114.34 146.91 39.93 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.927 0.394 . . . . 0.0 111.48 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.766 ' CB ' HD11 ' A' ' 37' ' ' LEU . 14.0 tp -120.3 124.49 45.72 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.183 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.409 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . . . -121.74 144.55 48.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.94 0.4 . . . . 0.0 110.048 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.79 172.8 15.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.089 -178.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -109.78 133.98 52.53 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.426 ' SG ' HD21 ' A' ' 98' ' ' LEU . 83.0 m -130.67 134.11 46.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.191 0.52 . . . . 0.0 112.139 -178.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.6 ptpt -66.43 137.3 56.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.506 -179.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 95' ' ' ASP . 72.8 p -86.06 -179.52 6.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.447 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -60.36 -29.87 69.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.655 0.264 . . . . 0.0 111.134 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.66 10.39 9.38 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 66.88 39.74 3.29 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.207 0.527 . . . . 0.0 112.052 -179.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.432 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 68.1 mt-30 -119.96 136.03 54.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.403 -0.817 . . . . 0.0 108.853 177.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.402 ' CE1' ' HB3' ' A' ' 24' ' ' LYS . 63.7 m-85 -92.09 126.39 37.15 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.023 0.439 . . . . 0.0 111.958 -178.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 29.3 m -131.09 152.49 37.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.163 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.3 t -72.96 134.39 44.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.135 0.493 . . . . 0.0 111.667 -179.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 t -145.76 161.57 39.62 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.362 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.409 ' HG3' ' HB2' ' A' ' 20' ' ' ALA . 20.2 ttpt -144.04 157.17 44.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.353 0.597 . . . . 0.0 112.139 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.412 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -135.21 129.4 50.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.834 179.498 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -88.52 116.44 26.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.558 0.218 . . . . 0.0 111.414 -178.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.806 HD22 HD22 ' A' ' 69' ' ' LEU . 4.2 mp -87.58 -15.91 36.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.325 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -47.28 73.44 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -178.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.415 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 3.2 m-20 -92.26 -10.33 38.9 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 122.169 -0.332 . . . . 0.0 111.755 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.434 ' HB3' HD12 ' A' ' 41' ' ' ILE . 21.7 m-70 -96.29 -64.9 1.01 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.63 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.9 mp -82.53 147.71 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.419 178.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -141.3 171.99 13.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.815 -0.629 . . . . 0.0 112.081 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.563 ' C ' HD12 ' A' ' 44' ' ' ILE . 22.6 t30 -112.87 113.21 25.18 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.941 -179.291 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.806 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.5 mp -113.59 89.49 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.937 0.399 . . . . 0.0 111.141 179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 50.1 t0 69.77 37.26 1.88 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.449 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.03 0.75 87.11 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.643 -0.789 . . . . 0.0 113.293 179.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 39.8 m -112.84 135.97 53.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 117.198 0.499 . . . . 0.0 110.8 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.444 HD12 ' OG ' ' A' ' 83' ' ' SER . 18.8 mt -77.18 117.19 18.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.635 0.731 . . . . 0.0 111.733 -177.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.806 ' HB2' HD13 ' A' ' 44' ' ' ILE . 30.0 mmtt -137.82 162.86 32.84 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.641 179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.875 ' CH2' HD11 ' A' ' 85' ' ' ILE . 3.6 m-90 -86.51 125.06 33.49 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.031 0.443 . . . . 0.0 111.99 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.404 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 12.2 tt0 -175.85 149.09 1.01 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.917 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.415 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 7.7 Cg_exo -69.04 66.75 1.34 Allowed 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.981 1.788 . . . . 0.0 112.061 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -156.81 131.38 8.74 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.184 179.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.68 109.36 15.15 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.258 0.552 . . . . 0.0 112.245 -177.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 41.1 p90 -48.15 -31.23 5.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.723 178.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.5 p -49.69 -18.28 0.44 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.676 -179.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -62.06 -30.18 70.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.597 0.237 . . . . 0.0 111.013 -179.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.431 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -126.74 -3.39 6.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.289 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.2 m -108.14 148.99 29.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.216 0.532 . . . . 0.0 112.118 -178.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.8 p90 -142.96 157.67 44.34 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.053 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 63.36 44.11 5.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.007 0.432 . . . . 0.0 110.728 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.745 ' O ' HD22 ' A' ' 13' ' ' LEU . 73.3 m -68.58 136.63 53.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.618 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.417 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.47 152.1 42.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.508 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.47 HG21 HD13 ' A' ' 19' ' ' LEU . 39.4 mt -129.01 139.68 51.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.238 0.542 . . . . 0.0 111.866 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -134.12 107.86 7.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.44 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.99 -120.19 13.4 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.4 -0.905 . . . . 0.0 111.3 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.3 p -99.88 -4.04 31.17 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.492 HG13 ' O ' ' A' ' 85' ' ' ILE . 12.6 t -103.15 140.09 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.806 HD22 HD22 ' A' ' 37' ' ' LEU . 8.5 tp -103.16 125.57 49.92 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.573 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.454 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -115.3 125.74 53.64 Favored 'General case' 0 N--CA 1.461 0.108 0 N-CA-C 110.094 -0.335 . . . . 0.0 110.094 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.3 t -151.86 153.59 34.5 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.69 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 10.7 m -95.53 126.12 40.59 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 70.8 m -127.45 146.7 50.4 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -178.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -75.27 137.1 40.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.108 178.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 30.5 mtm180 -91.98 143.98 25.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.19 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 14.2 m -51.83 -27.17 11.64 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -179.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -82.39 1.81 35.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.694 0.283 . . . . 0.0 111.436 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.92 136.04 7.54 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.817 179.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.18 -166.85 12.23 Favored Glycine 0 C--N 1.319 -0.362 0 N-CA-C 111.658 -0.577 . . . . 0.0 111.658 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -133.32 143.09 48.79 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.979 0.419 . . . . 0.0 111.163 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -154.3 132.95 12.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.119 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.3 t -94.22 134.38 36.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.842 0.353 . . . . 0.0 111.656 -179.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.444 ' OG ' HD12 ' A' ' 48' ' ' LEU . 23.5 p -119.8 157.76 27.96 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.192 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.7 m -121.44 142.38 50.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.916 0.389 . . . . 0.0 111.088 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.875 HD11 ' CH2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -147.78 144.51 19.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.613 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.753 ' N ' HD13 ' A' ' 85' ' ' ILE . 15.0 t0 -101.05 121.33 41.61 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.285 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.733 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 2.3 mt -100.66 -3.22 30.77 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -179.405 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.892 ' ND2' HG22 ' A' ' 5' ' ' ILE . 5.3 t-20 -45.3 -26.92 0.58 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.91 -42.12 24.77 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.666 HG11 ' CE2' ' A' ' 50' ' ' TRP . 4.1 m -72.63 -51.32 28.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -177.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.513 ' N ' HG23 ' A' ' 90' ' ' VAL . 2.7 mp -81.78 147.3 6.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.037 0.446 . . . . 0.0 111.347 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 99' ' ' LYS . 3.9 tt0 -138.62 166.8 23.42 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.972 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -107.69 99.93 9.37 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.191 0.52 . . . . 0.0 110.855 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.3 t -98.89 97.14 5.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.13 179.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.476 ' O ' HG22 ' A' ' 25' ' ' THR . 25.8 t0 53.79 33.13 16.24 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.7 28.4 12.53 Favored Glycine 0 CA--C 1.518 0.271 0 C-N-CA 120.585 -0.817 . . . . 0.0 113.206 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.9 m -141.41 135.48 30.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.867 0.365 . . . . 0.0 111.318 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.426 HD21 ' SG ' ' A' ' 23' ' ' CYS . 28.1 mt -74.39 119.4 18.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.44 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.404 ' O ' ' N ' ' A' ' 92' ' ' GLU . 0.3 OUTLIER -125.31 135.64 52.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.321 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 8.5 t80 . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.678 178.799 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.1 p90 . . . . . 0 N--CA 1.464 0.241 0 CA-C-O 120.706 0.289 . . . . 0.0 110.733 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.949 HG22 ' ND2' ' A' ' 88' ' ' ASN . 4.4 tp -62.48 -21.11 26.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.389 -179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -72.15 -24.28 61.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.744 0.307 . . . . 0.0 110.598 179.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.6 p -119.09 -3.99 10.6 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 86.3 m -107.19 152.07 24.56 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.811 0.339 . . . . 0.0 111.188 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -131.65 173.25 11.32 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.719 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 47.1 57.73 5.46 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.78 HG21 ' CD1' ' A' ' 5' ' ' ILE . 82.1 p -78.82 132.46 36.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.872 178.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.716 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.0 pt20 -158.57 164.34 36.17 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.959 0.409 . . . . 0.0 111.667 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.645 HD22 ' O ' ' A' ' 62' ' ' SER . 0.9 OUTLIER -97.5 135.8 38.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.497 -179.315 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.13 145.1 46.25 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.257 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 56.64 -150.27 27.16 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.318 -0.944 . . . . 0.0 111.425 -178.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.35 -37.82 18.08 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.789 0.662 . . . . 0.0 112.789 -178.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.449 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.9 p -141.17 37.1 1.73 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -114.66 148.75 37.74 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.943 0.401 . . . . 0.0 111.869 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.813 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.1 tp -121.89 122.35 39.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.191 179.198 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.73 143.43 46.22 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.38 172.68 16.13 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -113.63 133.36 55.34 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.555 ' SG ' HD21 ' A' ' 98' ' ' LEU . 54.7 m -130.47 132.78 45.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.148 0.499 . . . . 0.0 111.519 -178.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -64.84 137.95 58.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.671 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.403 HG22 ' O ' ' A' ' 95' ' ' ASP . 52.6 p -86.6 -177.42 6.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.771 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.8 mtp85 -61.48 -29.36 69.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.028 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.43 8.84 12.59 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 67.04 36.83 4.02 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.163 0.506 . . . . 0.0 111.274 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -117.07 134.53 54.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -90.99 124.92 35.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.119 0.485 . . . . 0.0 111.817 -178.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.6 m -130.16 150.86 35.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.635 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.7 t -72.03 136.57 46.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.345 0.593 . . . . 0.0 111.776 -178.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.7 t -145.34 162.35 37.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.212 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.414 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.9 OUTLIER -144.7 156.1 43.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.537 0.685 . . . . 0.0 111.92 -179.172 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.513 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -135.38 126.8 45.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.633 179.173 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -87.58 114.65 24.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.703 0.287 . . . . 0.0 110.807 -178.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.891 HD22 HD22 ' A' ' 69' ' ' LEU . 3.6 mp -86.15 -15.51 40.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.952 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -46.04 78.29 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.631 -0.428 . . . . 0.0 111.591 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.55 -10.2 41.49 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.45 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 30.3 m-70 -96.61 -60.34 1.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.525 HD13 ' CD1' ' A' ' 50' ' ' TRP . 32.8 mm -81.03 146.75 6.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.571 178.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.409 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -139.56 170.14 16.45 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.395 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.43 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 34.7 t30 -111.92 108.69 18.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.86 -179.249 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.453 HD11 HE21 ' A' ' 51' ' ' GLN . 48.2 mm -108.51 88.76 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.791 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 53.8 t0 66.43 39.42 3.94 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.827 0.346 . . . . 0.0 111.563 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.78 0.38 89.79 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 121.007 -0.616 . . . . 0.0 113.404 179.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.0 m -109.02 136.33 48.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 117.009 0.405 . . . . 0.0 110.958 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.479 HD22 HG21 ' A' ' 41' ' ' ILE . 12.6 mt -77.57 117.03 18.61 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.519 0.676 . . . . 0.0 111.408 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.7 mmtt -138.39 163.51 31.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.607 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.795 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 7.4 m-90 -84.77 124.27 31.37 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.976 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.453 HE21 HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -173.05 146.78 1.43 Allowed Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.848 -178.625 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -70.56 65.62 2.26 Favored 'Trans proline' 0 C--N 1.358 1.044 0 C-N-CA 122.464 2.11 . . . . 0.0 111.571 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.409 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.1 p -159.62 132.11 6.61 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.467 -1.242 . . . . 0.0 107.998 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.57 109.69 15.34 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -177.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.449 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.0 p90 -48.64 -30.31 5.3 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.974 177.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 35.4 p -49.92 -18.76 0.56 Allowed 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -63.1 -26.43 68.83 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.818 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.43 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 3.9 p -129.76 0.72 4.88 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.302 178.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.5 m -111.84 148.16 34.21 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.321 0.582 . . . . 0.0 112.268 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 35.5 p90 -141.7 157.99 44.37 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.528 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 64.3 42.56 5.25 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.838 0.351 . . . . 0.0 110.959 -179.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.645 ' O ' HD22 ' A' ' 13' ' ' LEU . 55.0 m -68.57 137.88 54.66 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.498 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.84 150.99 39.32 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.878 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.48 HG13 ' HB2' ' A' ' 13' ' ' LEU . 21.4 mt -129.09 140.24 49.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.47 0.652 . . . . 0.0 112.34 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -137.84 108.85 6.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.036 179.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.413 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 69.59 -122.64 12.44 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.322 -0.942 . . . . 0.0 111.145 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.405 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 24.6 p -100.91 -5.46 26.0 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 85' ' ' ILE . 3.2 t -101.1 140.77 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 120.995 0.426 . . . . 0.0 111.845 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.891 HD22 HD22 ' A' ' 37' ' ' LEU . 9.0 tp -104.28 127.61 51.94 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.655 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.469 ' N ' HD12 ' A' ' 69' ' ' LEU . 6.0 m -116.28 123.81 48.61 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.865 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.3 t -151.47 153.28 34.33 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.242 -0.183 . . . . 0.0 111.304 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.5 m -95.45 126.11 40.52 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 72.7 m -125.8 145.16 50.34 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -75.78 136.84 40.26 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.598 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 45.3 mtm180 -91.78 146.19 23.96 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.634 0.254 . . . . 0.0 110.693 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.4 m -52.25 -30.39 27.47 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -82.26 1.52 36.33 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.481 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.43 137.04 6.75 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.481 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 118.45 -176.43 16.11 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -127.73 141.58 51.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.576 0.688 . . . . 0.0 110.903 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -153.84 128.8 9.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.015 0.436 . . . . 0.0 110.665 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -92.18 135.48 33.96 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.894 -179.325 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.3 p -122.46 158.22 30.24 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.102 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 58.2 m -124.95 146.26 49.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.882 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.795 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 12.2 tt -146.34 143.69 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.769 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -95.41 119.72 34.39 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.386 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.562 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 7.1 mt -100.23 -5.81 27.0 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.949 ' ND2' HG22 ' A' ' 5' ' ' ILE . 11.1 t-20 -44.5 -29.1 0.66 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.13 -38.37 27.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.726 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -74.42 -52.43 19.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -178.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.608 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -82.81 146.37 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-O 120.859 0.362 . . . . 0.0 111.866 -178.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.405 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 21.4 tt0 -135.75 164.04 28.8 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.223 -178.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -107.05 99.75 9.28 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.38 0.61 . . . . 0.0 111.019 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 52.4 t -97.02 97.07 5.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.867 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.403 ' O ' HG22 ' A' ' 25' ' ' THR . 15.1 t0 51.65 33.3 10.57 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.03 28.75 9.63 Favored Glycine 0 C--N 1.329 0.168 0 C-N-CA 120.444 -0.884 . . . . 0.0 113.104 178.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 69.8 m -142.07 135.21 28.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.89 0.376 . . . . 0.0 111.035 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.555 HD21 ' SG ' ' A' ' 23' ' ' CYS . 44.5 mt -75.11 121.89 22.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.192 -179.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.1 mttm -126.59 134.35 50.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.118 0.485 . . . . 0.0 112.178 -179.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.45 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 10.1 t80 . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.43 179.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.434 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 16.0 p90 . . . . . 0 N--CA 1.467 0.38 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.928 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.2 tp -61.41 -20.73 23.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -74.12 -25.28 59.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.311 179.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.5 p -118.75 -5.95 10.63 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.667 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 66.3 m -104.91 152.77 22.24 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.08 0.467 . . . . 0.0 111.122 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -132.18 172.86 11.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.963 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 47.33 58.33 4.98 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.015 0.436 . . . . 0.0 111.721 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.781 HG21 ' CD1' ' A' ' 5' ' ' ILE . 54.4 p -79.11 130.27 35.33 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.664 178.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.649 ' O ' HD12 ' A' ' 19' ' ' LEU . 18.0 pt20 -156.67 164.13 38.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.778 -178.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.7 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.45 136.89 37.23 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.918 -179.902 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.82 144.23 48.45 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 60.27 -152.63 36.95 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 119.818 -1.182 . . . . 0.0 111.589 -179.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.7 m -86.64 -36.32 18.85 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.43 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.9 p -142.65 34.67 1.43 Allowed 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -178.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -113.51 151.22 31.82 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.957 0.408 . . . . 0.0 112.081 178.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.825 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.4 tp -124.85 124.88 43.02 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.411 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . . . -120.55 143.34 48.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.69 172.74 15.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.176 -178.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -114.43 133.94 55.36 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 32.3 m -130.74 132.98 45.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.114 0.483 . . . . 0.0 111.877 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 10.6 ptpt -65.74 137.83 57.53 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.435 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 95' ' ' ASP . 54.7 p -85.16 -176.31 6.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.575 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -62.34 -30.12 70.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.915 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.51 9.02 10.1 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 66.95 37.9 3.77 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.035 0.445 . . . . 0.0 111.806 -178.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.402 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 9.2 mt-30 -118.77 135.66 54.39 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 177.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -90.6 124.98 35.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.921 0.391 . . . . 0.0 111.995 -178.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.9 m -129.79 148.54 33.21 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.755 179.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.3 m -70.25 135.1 48.67 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.22 0.533 . . . . 0.0 111.959 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -144.62 161.81 38.22 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.344 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.411 ' HG3' ' HB2' ' A' ' 20' ' ' ALA . 28.7 ttpt -142.92 157.43 44.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.531 0.682 . . . . 0.0 112.333 -179.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.448 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -137.12 126.84 37.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.039 179.826 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -88.47 115.0 25.67 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.886 0.374 . . . . 0.0 111.535 -178.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.825 HD11 ' CB ' ' A' ' 19' ' ' LEU . 2.8 mp -85.66 -16.42 39.18 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.543 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.403 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -55.84 -48.15 75.99 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.637 0.256 . . . . 0.0 111.214 -179.047 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.403 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.2 OUTLIER -91.47 -10.43 40.89 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.736 -0.386 . . . . 0.0 111.594 179.515 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -95.05 -66.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.818 HD12 HD23 ' A' ' 37' ' ' LEU . 45.3 mt -79.85 151.19 4.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.747 178.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.35 172.28 12.91 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.029 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.417 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 37.1 t30 -109.2 109.68 20.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.809 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 44.7 mm -110.7 88.93 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.637 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.7 t70 68.15 39.84 2.31 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.604 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.15 1.14 90.52 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 120.625 -0.798 . . . . 0.0 113.094 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.3 m -112.54 137.05 51.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.88 0.371 . . . . 0.0 110.953 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 52.1 mt -76.66 116.07 17.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.548 0.69 . . . . 0.0 110.58 -178.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -135.18 161.96 33.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.609 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.74 ' CE2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -87.78 120.89 29.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.991 0.424 . . . . 0.0 111.512 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.435 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 20.2 tt0 -175.25 143.73 0.76 Allowed Pre-proline 0 N--CA 1.465 0.28 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.823 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.435 ' HD2' ' HG3' ' A' ' 51' ' ' GLN . 33.6 Cg_endo -64.25 75.71 0.18 Allowed 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 121.983 1.789 . . . . 0.0 112.91 -179.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -165.68 133.5 2.98 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.332 179.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.07 110.0 16.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.231 0.539 . . . . 0.0 112.151 -178.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.2 p90 -49.58 -29.16 6.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.573 178.451 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 61.5 p -49.6 -17.7 0.35 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -62.51 -28.14 69.64 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.595 0.235 . . . . 0.0 111.216 -179.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.417 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.4 p -129.84 -1.25 4.76 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.9 m -109.49 147.62 32.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.332 0.587 . . . . 0.0 112.482 -178.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -142.92 158.52 43.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.605 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 64.31 43.53 4.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.858 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.7 ' O ' HD22 ' A' ' 13' ' ' LEU . 74.3 m -68.64 137.06 53.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.931 179.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.436 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -144.0 152.93 41.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.291 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.498 ' CG1' HD13 ' A' ' 69' ' ' LEU . 43.5 mt -130.47 140.87 47.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.254 0.549 . . . . 0.0 111.717 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -137.17 107.96 6.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.668 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.71 -122.29 11.84 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.615 -0.802 . . . . 0.0 111.631 -178.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.5 p -101.08 -5.33 25.87 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.47 HG13 ' O ' ' A' ' 85' ' ' ILE . 10.6 t -101.41 139.56 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 120.882 0.372 . . . . 0.0 111.672 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.759 HD22 HD22 ' A' ' 37' ' ' LEU . 9.8 tp -101.67 127.73 48.29 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.675 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.477 ' N ' HD12 ' A' ' 69' ' ' LEU . 7.2 m -116.75 123.12 46.39 Favored 'General case' 0 N--CA 1.461 0.099 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.1 t -151.96 153.99 35.17 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.748 -178.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.5 m -94.34 125.66 39.12 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 178.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 88.4 m -125.61 142.87 51.28 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.228 0.537 . . . . 0.0 112.445 -178.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -74.46 138.5 43.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.728 178.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.5 mtp180 -91.43 144.56 25.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.629 0.252 . . . . 0.0 110.629 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 24.6 m -52.62 -27.65 17.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.326 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -82.16 2.45 31.45 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.678 0.275 . . . . 0.0 111.208 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.78 136.46 6.7 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.726 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.59 -170.24 13.22 Favored Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 111.245 -0.742 . . . . 0.0 111.245 -178.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -130.73 142.36 50.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 117.23 0.515 . . . . 0.0 111.226 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -154.0 130.15 10.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.459 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.4 t -93.39 134.9 35.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.037 0.446 . . . . 0.0 111.743 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 89.7 p -122.22 158.49 29.33 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.344 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.4 m -122.76 146.05 47.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.823 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.725 HD11 ' CH2' ' A' ' 50' ' ' TRP . 9.7 tt -147.76 143.46 19.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.037 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -97.07 119.82 36.27 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.684 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.535 ' HB3' HD12 ' A' ' 91' ' ' ILE . 9.4 mt -100.71 -6.41 25.08 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -178.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.928 ' ND2' HG22 ' A' ' 5' ' ' ILE . 6.2 t-20 -45.09 -29.72 0.95 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -178.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.3 t -81.28 -39.45 25.21 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.74 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.8 m -72.68 -52.1 24.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.632 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.85 147.33 6.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 0.0 110.764 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -138.49 165.94 25.55 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.097 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 29.0 t30 -106.59 99.7 9.26 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.221 0.534 . . . . 0.0 110.27 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -98.54 95.32 4.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.885 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.48 ' O ' HG22 ' A' ' 25' ' ' THR . 33.9 t0 52.13 32.61 10.76 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.573 0.225 . . . . 0.0 111.58 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.78 28.56 10.05 Favored Glycine 0 C--N 1.329 0.155 0 C-N-CA 120.593 -0.813 . . . . 0.0 113.635 178.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.1 m -141.65 134.33 28.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.932 0.366 . . . . 0.0 110.632 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.425 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 82.6 mt -73.26 120.6 19.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.678 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.407 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 11.7 mttt -125.91 141.07 52.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.136 0.493 . . . . 0.0 112.276 -178.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 22.6 t80 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.31 179.38 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.44 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 18.5 p90 . . . . . 0 CA--C 1.53 0.201 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.921 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.0 tp -63.4 -18.16 21.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.728 0.299 . . . . 0.0 111.495 -179.655 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -74.8 -24.31 58.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.978 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.1 p -118.71 15.1 13.57 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.649 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 56.5 m -131.47 154.09 49.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.171 0.51 . . . . 0.0 111.304 -179.655 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.4 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 6.3 ptt180 -132.76 173.19 11.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.676 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.419 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.7 p-10 48.95 56.71 7.34 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.648 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.0 p -79.37 133.75 36.59 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.565 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.677 ' O ' HD12 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -158.09 164.21 36.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.845 -178.911 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.714 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.41 136.35 37.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.994 -179.859 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.5 144.62 46.91 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.454 -0.794 . . . . 0.0 108.993 178.977 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.15 -152.16 29.45 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.847 -1.168 . . . . 0.0 111.846 -179.09 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.73 -36.7 20.01 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.343 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -142.53 35.92 1.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.8 mp0 -114.5 147.53 39.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.199 0.523 . . . . 0.0 111.689 179.09 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.768 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.3 tp -120.93 123.99 43.84 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.394 179.287 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.572 ' HB2' ' HE2' ' A' ' 34' ' ' LYS . . . -121.42 142.98 49.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.961 0.41 . . . . 0.0 110.105 179.712 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.59 172.64 16.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.945 -178.788 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -111.82 133.73 53.84 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 176.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.3 m -130.61 133.95 46.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.072 0.463 . . . . 0.0 111.66 -178.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 8.1 ptpt -67.11 137.49 56.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.704 -179.479 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.511 HG22 ' O ' ' A' ' 95' ' ' ASP . 72.1 p -85.59 -179.19 6.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.402 179.772 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -60.63 -29.77 69.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.659 0.266 . . . . 0.0 111.12 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.58 9.36 9.56 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -178.948 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 67.04 38.52 3.46 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.146 0.498 . . . . 0.0 111.911 -179.014 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.402 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 12.6 mm100 -119.53 134.95 54.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.515 -0.766 . . . . 0.0 108.968 178.06 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -92.25 124.94 36.69 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.025 0.44 . . . . 0.0 111.821 -178.62 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.2 m -129.87 150.46 34.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.735 179.667 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.8 p -71.25 134.4 46.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.239 0.542 . . . . 0.0 111.725 -178.737 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.3 t -142.74 161.86 36.97 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.295 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.572 ' HE2' ' HB2' ' A' ' 20' ' ' ALA . 17.6 ttmt -143.67 156.18 44.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.481 0.658 . . . . 0.0 112.187 -179.07 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.588 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -136.53 124.94 35.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 114.998 -1.001 . . . . 0.0 108.501 179.142 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -88.24 119.02 28.24 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.709 0.29 . . . . 0.0 111.294 -177.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.829 HD22 HD22 ' A' ' 69' ' ' LEU . 4.0 mp -89.04 -14.72 35.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.808 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.0 p-10 -57.87 -43.44 85.99 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.754 -178.467 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.423 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.5 OUTLIER -92.77 -10.52 36.64 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.944 -0.472 . . . . 0.0 111.611 178.691 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.463 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 26.6 m-70 -97.98 -64.2 1.06 Allowed 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.668 HD11 HD22 ' A' ' 87' ' ' LEU . 31.5 mm -80.07 145.73 8.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.444 178.764 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.457 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -137.92 171.46 14.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.5 -179.811 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.549 ' C ' HD12 ' A' ' 44' ' ' ILE . 20.2 t30 -113.12 111.71 22.58 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.251 -178.968 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.761 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.2 mp -112.7 95.03 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.394 179.192 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.3 t0 64.12 38.06 8.6 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.078 -179.561 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.08 11.63 82.17 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.218 179.374 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.7 m -120.4 136.49 54.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.024 0.412 . . . . 0.0 110.721 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.59 HD22 HG21 ' A' ' 41' ' ' ILE . 25.6 mt -77.42 118.1 19.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.559 0.695 . . . . 0.0 111.624 -177.976 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.761 ' HB2' HD13 ' A' ' 44' ' ' ILE . 25.6 mttt -139.15 163.42 32.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.006 -179.916 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.822 ' CH2' HD11 ' A' ' 85' ' ' ILE . 4.8 m-90 -85.4 119.0 25.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.956 0.408 . . . . 0.0 111.78 -179.413 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.457 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 18.0 mt-30 -169.4 151.45 4.51 Favored Pre-proline 0 N--CA 1.468 0.425 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.5 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.75 60.82 2.91 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 121.975 1.783 . . . . 0.0 112.394 -179.744 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.7 p -153.43 135.75 14.96 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.442 -0.799 . . . . 0.0 108.89 179.123 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -81.03 113.06 18.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -177.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.424 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 48.5 p90 -52.57 -33.49 46.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.414 178.316 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 60.1 p -48.97 -21.29 0.64 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.702 -179.11 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -62.0 -25.26 67.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.62 0.248 . . . . 0.0 110.898 -179.278 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.418 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -127.71 -2.24 6.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.127 178.797 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.8 m -111.09 148.36 32.83 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.25 0.548 . . . . 0.0 112.369 -178.277 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 41.3 p90 -140.12 157.33 45.8 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.053 179.538 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 41.1 m-20 62.99 45.15 5.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.059 0.457 . . . . 0.0 110.444 -178.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.714 ' O ' HD22 ' A' ' 13' ' ' LEU . 67.3 m -70.04 136.54 50.44 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.658 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.44 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -143.57 154.0 43.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.134 -179.618 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.522 HD13 HD13 ' A' ' 19' ' ' LEU . 47.0 mt -130.8 140.12 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.59 179.526 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -134.76 108.68 8.1 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.159 -0.928 . . . . 0.0 108.549 178.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.9 -119.68 11.26 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.327 -0.939 . . . . 0.0 111.193 -178.203 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.417 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 26.7 p -102.83 -3.49 26.24 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.411 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.53 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.3 t -101.55 137.58 28.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.93 0.395 . . . . 0.0 111.844 -179.835 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.829 HD22 HD22 ' A' ' 37' ' ' LEU . 9.3 tp -101.03 124.79 47.29 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.781 179.536 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.4 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.6 m -114.87 126.77 55.19 Favored 'General case' 0 CA--C 1.521 -0.144 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.349 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 t -151.68 153.62 34.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.73 0.3 . . . . 0.0 111.282 -179.127 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.6 m -94.3 125.61 39.04 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.703 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 85.9 m -128.55 147.2 50.69 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.44 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -75.48 136.79 40.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.179 178.505 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -91.7 144.05 25.92 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 179.282 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.3 m -52.19 -28.58 18.79 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.053 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -80.8 2.2 27.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.676 0.274 . . . . 0.0 111.504 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.03 135.06 6.7 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.561 179.99 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.5 -168.72 12.99 Favored Glycine 0 C--N 1.318 -0.442 0 N-CA-C 111.612 -0.595 . . . . 0.0 111.612 -179.0 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -131.2 141.14 50.01 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.877 0.339 . . . . 0.0 110.992 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -154.6 132.66 11.68 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.653 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -94.44 134.55 36.84 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.784 -179.367 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.5 p -121.46 157.99 29.38 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.897 0.38 . . . . 0.0 110.63 179.696 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 8.1 p -120.76 143.92 48.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.328 -179.511 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.822 HD11 ' CH2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -146.83 145.5 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.333 179.563 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.777 ' N ' HD13 ' A' ' 85' ' ' ILE . 21.0 t0 -101.5 121.54 42.15 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.422 -179.479 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.668 HD22 HD11 ' A' ' 41' ' ' ILE . 4.3 mt -103.46 -2.88 26.16 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -178.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.921 ' ND2' HG22 ' A' ' 5' ' ' ILE . 13.0 t-20 -44.87 -27.31 0.51 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.388 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.4 m -81.37 -39.13 25.49 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.64 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.644 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.7 m -75.3 -52.45 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -177.668 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.506 ' N ' HG23 ' A' ' 90' ' ' VAL . 2.6 mp -80.52 145.57 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.895 0.378 . . . . 0.0 110.969 -179.148 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -136.84 165.97 24.71 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.343 -178.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -105.9 99.28 8.88 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.116 0.484 . . . . 0.0 110.34 179.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.505 HG11 ' HE3' ' A' ' 99' ' ' LYS . 38.2 t -98.59 95.49 4.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.108 179.564 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.511 ' O ' HG22 ' A' ' 25' ' ' THR . 24.7 t0 55.35 31.88 17.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.626 0.251 . . . . 0.0 111.559 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.07 28.21 12.29 Favored Glycine 0 C--N 1.329 0.158 0 C-N-CA 120.745 -0.74 . . . . 0.0 113.156 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 74.0 m -140.3 135.09 31.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.757 0.313 . . . . 0.0 110.801 179.776 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 66.6 mt -73.48 121.19 20.16 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.085 -179.652 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.505 ' HE3' HG11 ' A' ' 94' ' ' VAL . 17.0 mttt -124.78 126.3 45.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.07 0.462 . . . . 0.0 111.572 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.463 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 56.0 t80 . . . . . 0 C--N 1.332 -0.185 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.637 179.837 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.475 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 17.5 p90 . . . . . 0 N--CA 1.465 0.299 0 CA-C-O 120.646 0.26 . . . . 0.0 111.584 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.946 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.2 tp -65.45 -14.68 17.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.68 0.276 . . . . 0.0 111.631 -179.447 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -74.91 -24.64 58.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.819 0.342 . . . . 0.0 110.717 179.424 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.4 p -118.65 -2.77 10.91 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.495 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 68.0 m -108.88 150.3 27.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.084 0.469 . . . . 0.0 111.236 -179.526 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.429 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.4 ptm180 -132.18 172.52 12.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.779 -179.861 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.429 ' OD1' ' O ' ' A' ' 9' ' ' ARG . 5.7 p-10 48.71 58.26 5.47 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.908 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.714 HG21 ' CD1' ' A' ' 5' ' ' ILE . 42.6 p -79.25 132.15 36.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.75 178.65 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.707 ' O ' HD12 ' A' ' 19' ' ' LEU . 13.4 pt20 -156.13 163.28 39.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.253 -179.228 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.752 HD22 ' O ' ' A' ' 62' ' ' SER . 0.8 OUTLIER -97.65 135.7 39.09 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.903 -179.754 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.54 144.31 48.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.12 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.07 -153.07 31.45 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.764 -1.208 . . . . 0.0 111.321 -178.761 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.55 -37.24 19.83 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -178.243 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.461 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.92 36.67 1.59 Allowed 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.201 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.1 mp0 -114.09 144.29 43.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.968 0.413 . . . . 0.0 111.317 178.617 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.799 ' CB ' HD11 ' A' ' 37' ' ' LEU . 13.4 tp -117.33 123.83 47.47 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.672 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.38 142.17 47.44 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.445 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.01 172.22 17.27 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.152 -178.591 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -116.06 133.58 55.87 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.751 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 32.1 m -130.73 134.52 46.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.131 0.491 . . . . 0.0 111.573 -179.104 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 4.0 ptpt -66.44 137.73 57.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.464 -179.473 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.9 p -85.06 -175.98 5.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.709 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.9 mmt85 -61.97 -30.46 70.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.809 0.337 . . . . 0.0 111.114 -179.811 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.84 9.04 10.73 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.839 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 66.77 38.46 3.82 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.292 0.568 . . . . 0.0 111.393 -178.739 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.463 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 13.9 mm100 -116.95 136.76 52.69 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 177.802 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -93.21 124.7 37.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.839 0.352 . . . . 0.0 111.549 -178.753 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.3 m -129.45 149.23 33.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.672 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.8 m -71.63 134.75 46.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.165 0.507 . . . . 0.0 111.523 -178.86 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.9 t -142.86 161.26 38.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.337 179.744 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -142.57 155.82 45.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.363 0.601 . . . . 0.0 111.848 -179.25 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.446 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.87 127.19 44.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.721 179.349 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -86.89 115.42 24.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.631 0.253 . . . . 0.0 110.946 -178.526 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.845 HD22 HD22 ' A' ' 69' ' ' LEU . 4.7 mp -85.87 -15.97 40.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.457 179.991 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.91 -47.28 74.58 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.366 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.405 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -92.05 -9.83 41.32 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 122.259 -0.275 . . . . 0.0 111.622 179.723 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.437 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 23.8 m-70 -95.69 -67.02 0.87 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.535 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.503 HD13 ' CD1' ' A' ' 50' ' ' TRP . 12.9 mm -79.79 148.33 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.486 178.641 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.414 ' HB1' ' OG ' ' A' ' 53' ' ' SER . . . -141.03 171.75 13.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.511 -179.753 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.537 ' C ' HD12 ' A' ' 44' ' ' ILE . 21.0 t30 -113.16 112.8 24.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.144 -179.158 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.868 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.4 mp -113.25 88.96 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.952 0.406 . . . . 0.0 110.903 179.276 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 43.5 t0 70.89 38.16 1.2 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.075 179.924 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.72 0.36 89.19 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.161 179.464 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.4 m -110.57 135.71 50.8 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 117.107 0.454 . . . . 0.0 110.943 179.923 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.3 mt -77.61 118.45 20.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.635 0.731 . . . . 0.0 111.508 -178.114 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.868 ' HB2' HD13 ' A' ' 44' ' ' ILE . 28.4 mttt -137.41 162.75 32.8 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.102 -179.938 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.76 ' CE2' HG11 ' A' ' 90' ' ' VAL . 8.0 m-90 -85.95 119.39 26.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.921 0.391 . . . . 0.0 111.235 -179.648 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.428 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 14.6 tt0 -174.32 148.26 1.28 Allowed Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.344 -179.798 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 14.2 Cg_exo -66.43 70.28 0.45 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.374 2.049 . . . . 0.0 112.796 -179.061 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.414 ' OG ' ' HB1' ' A' ' 42' ' ' ALA . 3.0 p -162.73 133.67 4.87 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.006 179.026 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -81.19 107.19 13.78 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.991 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.461 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.6 p90 -47.62 -30.84 3.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.479 178.219 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.2 p -47.28 -17.87 0.09 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.874 -179.404 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.1 mm-40 -64.85 -30.75 71.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.648 0.261 . . . . 0.0 111.14 -179.339 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.501 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.7 p -125.86 4.54 7.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.428 179.716 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.5 m -116.84 148.18 41.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.286 0.565 . . . . 0.0 111.992 -178.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 43.0 p90 -142.82 157.88 44.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.796 -179.945 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.7 m-20 63.02 45.65 5.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.996 0.427 . . . . 0.0 110.421 -179.097 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.752 ' O ' HD22 ' A' ' 13' ' ' LEU . 62.9 m -69.96 136.31 50.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.371 179.803 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -140.77 151.23 44.27 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.719 -179.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.542 HG21 HD13 ' A' ' 19' ' ' LEU . 26.2 mt -130.32 139.7 50.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-O 121.287 0.565 . . . . 0.0 111.894 -179.901 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -139.36 111.01 7.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.051 178.901 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.15 -123.12 13.9 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.407 -0.901 . . . . 0.0 111.354 -178.644 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.423 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 22.9 p -102.3 -3.75 26.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.252 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.641 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.7 t -101.74 139.85 21.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.987 0.422 . . . . 0.0 111.627 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.845 HD22 HD22 ' A' ' 37' ' ' LEU . 6.4 tp -102.2 126.87 49.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.22 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.546 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.0 m -117.17 125.15 50.75 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.913 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.3 t -151.92 153.65 34.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.629 0.252 . . . . 0.0 111.422 -178.831 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 25.2 m -94.85 126.26 40.06 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.526 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 76.5 m -126.67 145.38 50.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.381 0.61 . . . . 0.0 112.577 -178.555 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -74.61 137.46 42.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.649 178.362 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -93.2 144.82 24.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.763 0.316 . . . . 0.0 110.553 179.63 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 m -52.21 -26.12 10.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.488 -179.44 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -82.89 0.24 45.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.387 179.9 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.06 136.78 7.45 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.833 179.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.33 -166.36 12.15 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 -178.68 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -132.3 142.82 49.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.198 0.499 . . . . 0.0 111.299 -179.453 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -153.97 128.8 9.45 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.104 -179.897 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -92.45 134.82 34.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.652 -179.255 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 60.2 p -122.03 157.99 30.14 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.357 179.755 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.5 m -122.44 145.86 47.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.754 0.312 . . . . 0.0 111.165 -179.804 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.693 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.7 tt -144.13 143.39 23.61 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.176 -179.526 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -96.41 113.35 24.92 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.7 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.564 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 12.9 mt -96.5 -5.47 39.36 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -178.878 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.946 ' ND2' HG22 ' A' ' 5' ' ' ILE . 14.0 t-20 -44.71 -28.13 0.58 Allowed 'General case' 0 N--CA 1.467 0.417 0 O-C-N 122.111 -0.368 . . . . 0.0 111.936 -178.581 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 71.5 m -82.19 -39.37 23.25 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.896 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.76 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.4 m -72.89 -53.89 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -177.92 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.703 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.2 mp -82.57 147.73 5.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.935 0.397 . . . . 0.0 111.291 -179.066 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.428 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 6.7 tt0 -138.63 166.63 23.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.229 -178.839 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -107.08 99.77 9.3 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.13 0.49 . . . . 0.0 110.68 -179.769 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.445 HG21 ' CD ' ' A' ' 99' ' ' LYS . 39.2 t -98.33 96.83 5.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.035 179.421 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.8 t0 52.98 33.84 15.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.616 0.246 . . . . 0.0 111.535 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.2 28.6 12.91 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.414 179.397 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.6 t -141.24 135.28 30.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.822 0.344 . . . . 0.0 111.015 -179.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.428 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 67.9 mt -74.49 120.11 19.6 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.045 -179.787 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.476 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 10.7 mttm -122.47 139.13 54.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.932 -179.966 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.437 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 69.4 t80 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.579 -179.92 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.42 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 18.0 p90 . . . . . 0 N--CA 1.465 0.282 0 CA-C-O 120.603 0.239 . . . . 0.0 111.431 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.957 HG22 ' ND2' ' A' ' 88' ' ' ASN . 7.0 tp -63.41 -19.95 25.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.737 0.303 . . . . 0.0 111.159 -179.834 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -73.96 -24.01 59.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.676 179.25 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 p -118.58 13.96 13.49 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.445 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 62.1 m -130.76 154.72 47.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.992 0.425 . . . . 0.0 111.066 -179.595 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . 0.406 ' NH2' ' CZ ' ' A' ' 30' ' ' PHE . 15.0 ptp180 -132.99 172.73 12.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.04 -179.812 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.427 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.4 p-10 48.51 57.22 6.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.164 179.688 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.659 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.9 p -79.24 133.48 36.67 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.255 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.802 ' O ' HD12 ' A' ' 19' ' ' LEU . 1.3 pp0? -157.9 163.77 37.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.417 -179.013 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.778 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.43 135.12 39.76 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.949 -179.873 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.1 144.98 46.31 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 178.796 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.96 -153.24 30.68 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 119.726 -1.226 . . . . 0.0 111.504 -178.955 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.4 -36.57 19.07 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.351 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.82 35.67 1.78 Allowed 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.804 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 10.7 mp0 -115.95 148.91 39.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.092 0.472 . . . . 0.0 111.985 178.892 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.805 ' CB ' HD11 ' A' ' 37' ' ' LEU . 15.4 tp -123.79 124.61 43.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.173 179.012 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.26 143.27 46.7 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.68 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.36 172.63 16.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.463 -178.438 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -113.53 133.51 55.21 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 177.532 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 63.3 m -131.03 134.76 46.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.117 0.484 . . . . 0.0 111.962 -179.082 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -67.27 136.49 55.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.526 -179.613 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.42 HG22 ' HA3' ' A' ' 96' ' ' GLY . 65.4 p -86.29 -178.9 6.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.521 179.814 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -60.29 -29.22 68.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.785 0.326 . . . . 0.0 110.957 -179.712 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.75 8.53 9.81 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.798 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 66.66 38.13 4.1 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.324 0.583 . . . . 0.0 111.086 -178.692 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.427 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 9.9 mt-30 -119.8 135.57 54.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.039 178.376 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.406 ' CZ ' ' NH2' ' A' ' 9' ' ' ARG . 50.3 m-85 -92.77 124.73 36.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.963 0.411 . . . . 0.0 111.35 -178.981 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.4 m -128.64 151.02 34.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.91 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.4 p -70.95 133.01 46.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.168 0.509 . . . . 0.0 111.835 -178.555 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.2 t -143.4 161.42 38.42 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.323 179.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -143.77 155.28 44.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.231 0.539 . . . . 0.0 111.904 -178.936 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.736 HD11 ' HD1' ' A' ' 100' ' ' TYR . 1.1 tp -135.44 126.36 44.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.274 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -87.2 117.23 25.81 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.709 0.29 . . . . 0.0 111.136 -178.337 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.909 HD22 HD22 ' A' ' 69' ' ' LEU . 3.9 mp -87.74 -15.59 36.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.986 -179.623 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -58.24 -43.5 87.85 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.39 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 4.0 m-20 -91.97 -10.08 40.65 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.024 -0.423 . . . . 0.0 111.195 179.084 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.501 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 25.8 m-70 -96.74 -63.06 1.17 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.633 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.624 HD11 HD22 ' A' ' 87' ' ' LEU . 24.1 mm -80.59 149.87 4.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.547 178.443 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.527 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.0 172.05 13.32 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.398 -179.773 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.439 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 32.4 t30 -112.7 107.8 16.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.017 -179.021 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 48.0 mm -109.81 91.07 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.182 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.7 t70 66.25 39.58 4.1 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.005 -179.822 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 81.39 1.18 89.97 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.729 179.889 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 m -108.56 137.74 46.01 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.912 0.387 . . . . 0.0 111.253 -179.883 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.465 HD12 ' O ' ' A' ' 83' ' ' SER . 20.4 mt -77.19 115.82 17.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.592 0.711 . . . . 0.0 111.341 -178.151 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -137.71 162.83 32.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.201 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.756 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 5.8 m-90 -86.67 122.38 30.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.892 0.377 . . . . 0.0 111.717 -179.35 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.527 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 1.8 mt-30 -172.14 149.52 2.21 Favored Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.133 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.416 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 53.7 Cg_endo -71.66 64.85 3.07 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 121.932 1.754 . . . . 0.0 112.353 -179.811 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.61 134.09 9.74 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.174 179.02 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.422 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.2 OUTLIER -81.04 110.13 16.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.509 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.435 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 47.9 p90 -49.25 -30.31 7.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.88 178.529 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.4 p -49.33 -18.15 0.34 Allowed 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -179.025 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -62.21 -28.07 69.43 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.889 -0.324 . . . . 0.0 111.17 -179.104 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.439 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -128.73 -1.89 5.38 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 179.703 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 72' ' ' THR . 5.8 m -108.72 149.43 29.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.125 0.488 . . . . 0.0 112.083 -178.594 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.2 p90 -141.52 157.26 45.35 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.301 179.903 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 64.14 47.68 3.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.84 -179.197 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.778 ' O ' HD22 ' A' ' 13' ' ' LEU . 55.8 m -70.1 135.38 49.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.788 179.73 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.29 152.32 42.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.714 -179.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.597 HG21 HD13 ' A' ' 19' ' ' LEU . 45.7 mt -130.96 140.33 48.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.253 0.549 . . . . 0.0 111.974 -179.724 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -136.26 109.77 7.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.274 179.208 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.47 -119.82 13.6 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.303 -0.951 . . . . 0.0 110.939 -178.457 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.413 ' HB3' ' HB ' ' A' ' 5' ' ' ILE . 24.8 p -102.34 -3.29 27.36 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.464 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.5 t -101.9 136.97 31.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.022 0.439 . . . . 0.0 111.811 179.975 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.909 HD22 HD22 ' A' ' 37' ' ' LEU . 5.3 tp -101.8 125.48 48.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.301 179.813 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.546 ' N ' HD12 ' A' ' 69' ' ' LEU . 16.7 m -115.46 126.36 54.23 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.5 t -151.77 153.54 34.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.792 0.33 . . . . 0.0 111.649 -178.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.6 m -95.42 126.02 40.43 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.812 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.9 m -126.19 144.5 50.74 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.598 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -74.31 137.64 43.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.375 178.037 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.2 mtm-85 -91.94 142.37 27.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.668 0.27 . . . . 0.0 110.593 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.2 m -52.21 -27.0 13.03 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.612 -179.361 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -83.05 1.98 37.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.706 0.289 . . . . 0.0 111.393 179.924 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.49 134.07 6.53 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.497 -179.873 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.11 -171.07 13.58 Favored Glycine 0 C--N 1.318 -0.459 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.625 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -132.19 144.19 50.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 117.28 0.54 . . . . 0.0 111.337 -179.905 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -154.39 132.29 11.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.245 179.879 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -94.45 134.44 36.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.306 -179.642 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.465 ' O ' HD12 ' A' ' 48' ' ' LEU . 38.3 p -120.61 158.28 27.72 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.283 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.07 144.33 48.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.26 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.756 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.4 tt -144.51 143.83 22.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.693 179.913 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -98.0 118.31 34.32 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.942 179.524 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.636 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 4.8 mt -100.32 -6.05 26.45 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -179.06 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.957 ' ND2' HG22 ' A' ' 5' ' ' ILE . 14.1 t-20 -44.63 -28.25 0.58 Allowed 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -178.349 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 13.2 m -82.2 -39.53 22.99 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.659 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -72.32 -52.62 23.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 N-CA-C 113.445 0.905 . . . . 0.0 113.445 -177.943 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.515 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -81.55 147.3 6.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.131 0.491 . . . . 0.0 111.238 -179.17 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.45 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 15.3 tt0 -137.62 165.63 25.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.061 -178.617 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -107.63 100.16 9.58 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.235 0.54 . . . . 0.0 110.728 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.2 t -98.34 98.44 7.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.78 179.039 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.8 t0 54.17 32.55 16.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.672 0.272 . . . . 0.0 111.41 -179.801 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.42 ' HA3' HG22 ' A' ' 25' ' ' THR . . . 93.49 28.46 11.41 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.316 179.297 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.1 m -140.38 137.35 33.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.918 0.39 . . . . 0.0 111.571 -179.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.45 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 57.0 mt -74.38 119.04 18.04 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.686 179.873 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.434 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.5 mttm -126.57 145.35 50.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.671 -179.112 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.736 ' HD1' HD11 ' A' ' 35' ' ' ILE . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.023 179.406 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.417 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 13.2 p90 . . . . . 0 N--CA 1.467 0.42 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.928 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.5 tp -62.64 -19.14 22.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.601 0.239 . . . . 0.0 111.544 -179.467 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -74.38 -25.64 59.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.615 0.245 . . . . 0.0 111.037 179.293 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.1 p -118.91 -0.94 11.09 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.641 179.287 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 80.6 m -109.84 151.42 27.03 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.898 0.38 . . . . 0.0 111.279 -179.706 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.1 172.24 12.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.015 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 48.88 58.76 4.98 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -179.871 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.749 HG21 ' CD1' ' A' ' 5' ' ' ILE . 12.6 p -79.25 134.07 36.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.84 178.622 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.69 ' O ' HD12 ' A' ' 19' ' ' LEU . 2.5 pt20 -157.26 163.65 38.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.507 -179.183 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.774 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.66 135.42 39.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.097 -179.869 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -118.61 144.17 46.31 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 178.657 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.81 -152.11 32.3 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 119.753 -1.213 . . . . 0.0 111.566 -179.01 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.99 -36.64 18.14 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.413 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.73 34.87 1.79 Allowed 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -178.588 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.8 OUTLIER -115.36 148.54 39.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.106 0.479 . . . . 0.0 112.06 178.788 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.817 ' CB ' HD11 ' A' ' 37' ' ' LEU . 12.6 tp -122.31 123.76 42.17 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.46 179.504 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.07 143.97 47.84 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.901 0.381 . . . . 0.0 110.031 179.405 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.6 172.56 16.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.876 -178.539 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -112.56 133.57 54.55 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 176.893 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 58.4 m -130.59 133.57 46.29 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.51 -0.476 . . . . 0.0 112.026 -178.924 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 3.7 ptpt -66.03 136.95 56.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.664 -179.78 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.496 HG22 ' O ' ' A' ' 95' ' ' ASP . 63.7 p -85.98 -176.92 6.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.566 179.872 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -61.52 -29.72 70.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.674 0.273 . . . . 0.0 111.183 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.0 8.39 10.71 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.622 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 66.26 38.08 4.69 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.216 0.531 . . . . 0.0 111.196 -178.725 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.412 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 32.9 mt-30 -118.58 135.83 54.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.664 178.307 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -92.88 124.53 36.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.061 0.458 . . . . 0.0 111.786 -178.518 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.7 m -130.3 151.29 35.65 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.723 -179.983 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.4 t -72.44 136.46 46.01 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.166 0.508 . . . . 0.0 112.079 -178.723 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 t -145.13 161.72 38.8 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.265 179.884 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt -143.1 157.19 44.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.48 0.657 . . . . 0.0 112.177 -179.215 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.467 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.7 OUTLIER -136.74 125.6 36.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.922 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -88.32 119.56 28.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.621 0.248 . . . . 0.0 110.977 -177.93 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 69' ' ' LEU . 3.9 mp -88.94 -14.88 35.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.488 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.2 p-10 -57.4 -45.61 84.35 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.222 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.436 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 3.8 p30 -92.83 -10.48 36.64 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.906 -0.496 . . . . 0.0 111.377 178.567 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.47 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 9.5 m-70 -94.29 -66.07 0.94 Allowed 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.959 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.622 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.6 mp -81.24 150.64 4.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.938 178.809 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.542 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.98 171.68 13.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.808 -179.032 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.541 ' C ' HD12 ' A' ' 44' ' ' ILE . 23.7 t30 -113.25 111.52 22.18 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.367 -179.202 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.79 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.4 mp -112.45 89.32 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-O 120.918 0.389 . . . . 0.0 111.161 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t0 67.32 38.13 3.37 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.937 179.369 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.54 0.85 87.98 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.473 -0.87 . . . . 0.0 113.158 179.307 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.1 m -112.94 136.48 52.56 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.193 0.496 . . . . 0.0 110.842 179.776 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.9 mt -77.38 117.97 19.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.649 0.738 . . . . 0.0 112.541 -177.521 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.79 ' HB2' HD13 ' A' ' 44' ' ' ILE . 40.6 mttt -139.61 163.01 33.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.545 179.475 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.766 ' CH2' HD11 ' A' ' 85' ' ' ILE . 9.5 m-90 -87.7 127.08 35.3 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.892 0.331 . . . . 0.0 111.892 -179.4 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.542 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.1 OUTLIER -172.92 159.14 3.57 Favored Pre-proline 0 N--CA 1.468 0.432 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.686 -179.785 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -77.02 61.55 7.21 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 122.118 1.879 . . . . 0.0 112.142 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.1 p -156.47 135.34 11.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.85 -1.068 . . . . 0.0 108.599 179.193 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.29 109.87 16.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.227 0.536 . . . . 0.0 112.139 -178.182 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -46.41 -30.02 1.96 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.087 178.764 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.6 p -50.65 -17.11 0.47 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -179.049 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -61.2 -29.37 69.77 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.838 -179.308 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.404 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.3 p -129.68 0.63 4.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.531 179.249 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.9 m -110.86 148.3 32.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.3 0.572 . . . . 0.0 112.06 -178.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -141.72 157.53 44.94 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.021 -179.682 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 63.71 45.62 4.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.912 0.387 . . . . 0.0 110.879 -179.356 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.774 ' O ' HD22 ' A' ' 13' ' ' LEU . 58.1 m -69.01 137.2 53.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.513 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.408 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -143.58 152.13 41.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.071 -179.433 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.507 HG21 HD13 ' A' ' 19' ' ' LEU . 39.9 mt -131.01 140.27 49.05 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 121.302 0.573 . . . . 0.0 112.239 -179.898 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -137.88 110.68 7.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.273 179.271 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.66 -121.71 17.95 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.368 -0.92 . . . . 0.0 111.171 -178.602 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.414 ' HB3' HG21 ' A' ' 5' ' ' ILE . 21.1 p -100.49 -2.92 31.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.984 0.392 . . . . 0.0 112.002 -179.408 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.579 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.4 t -103.57 138.41 28.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -179.633 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 37' ' ' LEU . 6.7 tp -102.85 124.64 48.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.615 179.606 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.466 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.7 m -115.52 126.65 54.54 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -179.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.2 t -151.89 153.8 34.87 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.128 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 8.3 m -95.06 126.42 40.39 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 178.814 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 73.4 m -127.32 146.3 50.49 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -178.266 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -75.82 137.29 40.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.631 178.042 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 47.8 mtm-85 -92.06 146.04 24.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.743 0.306 . . . . 0.0 110.601 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.1 m -51.92 -31.41 28.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.851 -179.169 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -81.74 2.82 28.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.619 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.19 136.27 6.83 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.34 -179.82 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.0 -173.46 14.71 Favored Glycine 0 C--N 1.317 -0.498 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 -178.41 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -131.65 143.24 50.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.398 0.599 . . . . 0.0 111.484 -179.798 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -154.44 130.81 10.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.38 179.563 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 0.9 OUTLIER -92.46 134.28 35.1 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.157 -179.763 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.6 p -119.72 158.65 26.06 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.383 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.47 144.66 48.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.338 -179.52 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.766 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.8 tt -146.97 145.01 19.71 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.577 179.728 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -98.25 118.7 35.47 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.648 179.502 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.533 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 7.0 mt -99.72 -6.46 27.07 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -178.738 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.928 ' ND2' HG22 ' A' ' 5' ' ' ILE . 5.6 t-20 -45.06 -28.61 0.73 Allowed 'General case' 0 N--CA 1.468 0.442 0 O-C-N 122.17 -0.331 . . . . 0.0 111.825 -178.532 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 7.5 m -80.35 -39.61 28.22 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.705 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.0 m -73.5 -52.58 20.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -178.367 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.614 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.1 mp -81.75 147.32 6.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.927 0.394 . . . . 0.0 111.235 -179.174 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -137.16 165.42 26.14 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.179 -178.709 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -106.4 99.83 9.39 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.133 0.492 . . . . 0.0 110.708 -179.651 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.7 t -99.26 96.75 5.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.171 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.496 ' O ' HG22 ' A' ' 25' ' ' THR . 15.8 t0 52.7 33.37 13.74 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 179.742 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.23 28.43 11.72 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.748 -0.739 . . . . 0.0 113.206 179.235 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.0 t -141.63 134.31 28.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.779 0.323 . . . . 0.0 111.174 -179.831 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.409 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 73.8 mt -74.75 120.34 20.16 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.054 0.454 . . . . 0.0 110.88 179.923 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -123.3 138.97 54.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.281 -179.71 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.47 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 36.2 t80 . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.476 179.518 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.464 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 22.7 p90 . . . . . 0 N--CA 1.464 0.235 0 CA-C-O 120.585 0.231 . . . . 0.0 111.289 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.954 HG22 ' ND2' ' A' ' 88' ' ' ASN . 6.4 tp -64.46 -16.32 19.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.714 0.292 . . . . 0.0 111.397 -179.871 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -76.04 -24.95 55.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.817 0.342 . . . . 0.0 110.802 179.36 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.4 p -118.29 -4.04 10.96 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.656 179.775 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 60.4 m -109.69 153.64 23.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.161 0.505 . . . . 0.0 111.067 -179.557 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 22.2 ptt180 -132.27 173.03 11.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.615 -179.948 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.402 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.9 p-10 49.12 58.01 5.85 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.011 0.434 . . . . 0.0 112.027 179.867 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.616 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.1 p -79.31 130.02 35.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.952 178.801 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.708 ' O ' HD12 ' A' ' 19' ' ' LEU . 1.8 pt20 -156.15 163.15 39.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.38 -179.403 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.72 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.64 136.57 37.82 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.467 179.901 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -121.03 144.6 48.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.071 179.273 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.21 -152.09 29.86 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 119.85 -1.167 . . . . 0.0 111.36 -178.759 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.16 -37.07 19.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.098 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.34 36.59 1.69 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.92 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 3.2 mp0 -115.71 145.74 42.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.15 0.5 . . . . 0.0 111.512 178.922 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.806 ' CB ' HD11 ' A' ' 37' ' ' LEU . 13.3 tp -119.92 123.79 44.42 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 178.913 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.29 142.89 46.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.876 0.369 . . . . 0.0 110.041 179.595 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.22 172.28 16.96 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.001 -178.795 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -114.39 133.55 55.63 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.69 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.407 ' SG ' HD21 ' A' ' 98' ' ' LEU . 39.4 m -130.61 133.38 46.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.134 0.492 . . . . 0.0 111.709 -179.12 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 3.1 ptpt -66.59 137.99 57.15 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.451 -179.624 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 21.1 p -85.48 -177.13 6.36 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.637 179.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.4 mtt-85 -61.33 -30.35 70.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.298 -179.673 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.77 9.46 9.7 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -179.099 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 66.84 38.34 3.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.223 0.535 . . . . 0.0 111.609 -178.838 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.503 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 16.0 mm100 -116.8 137.68 52.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.811 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -94.65 124.77 38.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.896 0.379 . . . . 0.0 111.883 -178.778 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 23.5 m -130.47 151.47 35.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.914 179.543 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.3 m -72.45 134.87 45.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.223 0.535 . . . . 0.0 111.617 -178.842 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.2 t -141.75 161.51 37.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.002 179.713 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -140.74 154.14 46.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.462 0.649 . . . . 0.0 112.007 -178.895 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.477 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -138.36 122.58 21.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.0 -1.0 . . . . 0.0 108.61 179.214 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -86.57 119.14 26.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.824 0.345 . . . . 0.0 110.863 -178.646 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.848 HD22 HD22 ' A' ' 69' ' ' LEU . 4.4 mp -87.0 -15.56 38.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.757 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.447 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -57.49 -45.92 84.31 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.024 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.447 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.3 m-20 -92.13 -10.04 40.33 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 122.101 -0.375 . . . . 0.0 111.53 179.599 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 39.4 m-70 -98.63 -67.45 0.85 Allowed 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.799 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.561 HD12 ' N ' ' A' ' 41' ' ' ILE . 3.3 mp -81.13 149.71 4.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.407 178.783 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.474 ' HB3' ' CG ' ' A' ' 51' ' ' GLN . . . -141.4 172.57 12.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.148 -179.37 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.482 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 12.9 t30 -112.45 114.68 27.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.98 179.682 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.703 HD11 ' OE1' ' A' ' 51' ' ' GLN . 49.7 mm -113.41 89.35 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.384 -179.641 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 56.8 t0 71.12 38.53 1.08 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.95 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.41 0.68 88.25 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.889 179.779 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.9 m -115.2 136.29 53.26 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.917 0.389 . . . . 0.0 110.814 179.793 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.6 mt -77.5 120.26 22.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.516 0.674 . . . . 0.0 111.545 -178.16 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -135.37 162.06 33.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.873 179.877 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.769 ' CE2' HG11 ' A' ' 90' ' ' VAL . 8.0 m-90 -89.2 117.61 28.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.061 0.458 . . . . 0.0 112.193 -179.065 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.703 ' OE1' HD11 ' A' ' 44' ' ' ILE . 3.0 pt20 -178.55 151.12 0.72 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.974 178.656 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.415 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 28.4 Cg_endo -63.21 81.98 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.263 1.975 . . . . 0.0 113.118 -178.697 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.414 ' OG ' ' CB ' ' A' ' 42' ' ' ALA . 3.0 p -172.38 131.92 0.61 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.018 178.938 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.81 108.87 15.69 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -177.921 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 25.1 p90 -47.91 -29.77 3.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.469 178.544 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.7 p -48.8 -15.92 0.11 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.217 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -64.63 -30.79 71.82 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.599 -178.79 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.482 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -129.75 2.81 4.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.504 0.192 . . . . 0.0 111.301 179.763 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.6 m -112.2 148.03 34.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.207 0.527 . . . . 0.0 111.827 -179.013 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -142.48 157.37 44.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.017 -179.724 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 63.33 47.61 3.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.961 0.41 . . . . 0.0 110.693 -179.187 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.72 ' O ' HD22 ' A' ' 13' ' ' LEU . 21.1 m -70.11 136.36 50.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.598 179.865 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.513 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.04 152.09 43.04 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.494 179.791 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.499 HG21 HD13 ' A' ' 19' ' ' LEU . 34.6 mt -130.28 140.6 48.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.219 0.533 . . . . 0.0 111.649 -179.933 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -137.44 110.6 7.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.236 -0.893 . . . . 0.0 108.99 179.059 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.68 -122.33 16.9 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.24 -0.981 . . . . 0.0 111.179 -178.651 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.427 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 20.8 p -101.18 -4.33 27.43 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -179.521 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.509 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.5 t -101.74 139.56 22.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.969 0.414 . . . . 0.0 111.691 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.848 HD22 HD22 ' A' ' 37' ' ' LEU . 8.0 tp -102.22 127.82 49.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.356 179.834 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.524 ' N ' HD12 ' A' ' 69' ' ' LEU . 6.8 m -117.24 124.34 48.82 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.6 t -151.26 153.32 34.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.686 -0.233 . . . . 0.0 111.159 -178.881 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.9 m -93.14 125.96 38.0 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.015 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.3 m -127.14 144.34 51.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.316 0.579 . . . . 0.0 112.52 -178.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -74.84 138.1 42.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.857 178.454 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 59.5 mtp180 -92.65 143.55 26.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.66 0.267 . . . . 0.0 110.53 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.2 m -51.83 -25.63 8.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.565 -0.288 . . . . 0.0 111.448 -179.429 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -82.79 0.84 41.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.762 0.315 . . . . 0.0 111.442 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.36 135.86 6.73 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.437 -179.935 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.55 -168.49 12.76 Favored Glycine 0 C--N 1.319 -0.386 0 N-CA-C 111.298 -0.721 . . . . 0.0 111.298 -178.742 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -131.19 141.63 50.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 117.145 0.473 . . . . 0.0 111.246 -179.626 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -154.28 130.71 10.54 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.26 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -93.35 134.37 35.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.303 -179.478 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 p -120.9 158.47 27.59 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.902 0.382 . . . . 0.0 110.542 179.911 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 60.5 p -120.6 143.74 48.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.751 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 14.4 tt -144.51 142.07 23.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.382 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -96.31 116.6 29.28 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.213 179.876 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.662 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 10.0 mt -96.64 -6.64 36.18 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -179.025 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.954 ' ND2' HG22 ' A' ' 5' ' ' ILE . 12.1 t-20 -44.99 -29.48 0.84 Allowed 'General case' 0 N--CA 1.466 0.355 0 O-C-N 122.186 -0.322 . . . . 0.0 111.705 -178.652 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.75 -41.0 24.24 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.947 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.769 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -71.01 -53.19 22.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 113.358 0.874 . . . . 0.0 113.358 -177.91 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.57 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.81 147.79 5.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.992 0.425 . . . . 0.0 111.568 -178.836 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.412 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 13.4 tt0 -137.02 165.66 25.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.866 -179.074 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -107.57 99.71 9.19 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.112 0.482 . . . . 0.0 110.25 179.837 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . 0.401 HG23 ' HB2' ' A' ' 99' ' ' LYS . 38.9 t -98.81 96.69 5.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.136 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.8 t0 52.75 33.99 15.23 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.716 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.5 28.07 12.05 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.845 -0.693 . . . . 0.0 113.389 179.155 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.1 t -141.89 135.46 29.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.789 0.328 . . . . 0.0 111.401 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.412 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 64.3 mt -73.59 119.26 17.57 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.425 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.405 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.0 mttm -125.29 148.63 48.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.647 -178.995 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.9 t80 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.902 -179.841 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.407 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 15.8 p90 . . . . . 0 N--CA 1.464 0.262 0 CA-C-O 120.597 0.237 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.954 HG22 ' ND2' ' A' ' 88' ' ' ASN . 3.9 tp -66.06 -13.64 16.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.727 0.299 . . . . 0.0 111.101 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -77.34 -27.36 52.74 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.016 0.436 . . . . 0.0 109.874 178.932 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 42.6 p -118.74 11.22 12.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.138 178.755 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.7 m -124.94 149.88 47.18 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.153 0.501 . . . . 0.0 111.616 -179.043 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -133.64 173.0 11.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.797 179.764 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 p30 49.99 56.91 7.16 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.792 0.437 . . . . 0.0 112.07 -179.743 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.801 HG21 ' CD1' ' A' ' 5' ' ' ILE . 25.0 p -79.27 133.8 36.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.898 178.588 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.688 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.9 pt20 -157.09 163.68 38.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.571 -179.166 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.761 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.7 136.08 38.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.905 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.92 144.31 48.51 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.1 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.67 -152.92 34.07 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 119.866 -1.159 . . . . 0.0 111.281 -178.859 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.57 -37.05 20.02 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.43 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -142.09 35.61 1.54 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -179.085 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 2.1 mp0 -113.28 147.27 37.91 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.959 0.409 . . . . 0.0 111.511 178.604 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.807 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.9 tp -119.65 124.79 47.14 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.983 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.01 143.32 49.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.531 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.65 172.64 15.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.187 -178.795 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -111.2 133.85 53.23 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.044 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.3 m -130.82 133.98 46.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.124 0.488 . . . . 0.0 111.881 -179.089 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 8.3 ptpt -66.03 136.79 56.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.382 -179.606 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.8 p -85.45 -176.29 6.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.52 179.85 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 39.4 mtm180 -61.54 -30.68 70.8 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.642 0.258 . . . . 0.0 111.316 -179.615 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.86 9.89 10.97 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.097 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 66.57 39.45 3.75 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.263 0.554 . . . . 0.0 111.614 -178.795 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.434 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 50.0 mt-30 -117.12 136.44 53.0 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.565 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -92.56 124.33 36.51 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.614 -178.688 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.6 m -128.89 149.08 33.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.354 179.448 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.7 m -72.36 136.7 46.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.269 0.557 . . . . 0.0 111.616 -178.847 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -142.17 161.21 38.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.148 179.668 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.9 154.22 47.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.394 0.616 . . . . 0.0 112.012 -179.379 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.512 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -136.89 126.43 37.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.096 -0.957 . . . . 0.0 108.858 179.656 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -87.94 115.52 25.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.609 0.243 . . . . 0.0 111.622 -178.032 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.912 HD22 HD22 ' A' ' 69' ' ' LEU . 3.8 mp -87.03 -16.33 35.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.22 179.359 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.66 -45.13 81.86 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.691 0.281 . . . . 0.0 111.399 -178.863 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.409 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -92.05 -10.49 38.95 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 122.241 -0.287 . . . . 0.0 111.617 179.633 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' HIS . . . . . 0.487 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 17.7 m-70 -97.43 -64.47 1.04 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.503 HD11 HD22 ' A' ' 87' ' ' LEU . 29.8 mm -79.77 148.05 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.645 179.026 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -140.01 172.04 13.33 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.603 -179.775 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.54 ' C ' HD12 ' A' ' 44' ' ' ILE . 32.9 t30 -113.02 111.23 21.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.378 -178.939 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.763 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.2 mp -111.21 89.49 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.915 179.289 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.1 t70 67.95 38.14 2.87 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.105 -179.958 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.71 2.39 88.71 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.627 -0.797 . . . . 0.0 113.231 179.448 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.2 m -111.5 136.32 50.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.201 0.501 . . . . 0.0 111.162 -179.946 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.1 mt -77.5 117.47 18.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.616 0.722 . . . . 0.0 111.384 -178.199 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.763 ' HB2' HD13 ' A' ' 44' ' ' ILE . 8.9 mttm -138.45 163.01 33.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.128 -179.841 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' TRP . . . . . 0.726 ' CE2' HG11 ' A' ' 90' ' ' VAL . 7.3 m-90 -85.91 119.82 26.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.991 0.424 . . . . 0.0 111.493 -179.464 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.454 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 40.5 tt0 -174.99 143.52 0.77 Allowed Pre-proline 0 N--CA 1.463 0.221 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.359 -179.983 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.454 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 29.6 Cg_endo -64.68 72.09 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 122.289 1.993 . . . . 0.0 112.868 -179.171 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.9 p -163.44 133.8 4.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.4 178.932 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.47 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.41 109.88 15.33 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.682 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 12.7 p90 -50.09 -30.47 11.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.721 178.522 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.421 ' N ' ' CD1' ' A' ' 55' ' ' PHE . 77.3 p -48.4 -19.63 0.33 Allowed 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -179.196 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -60.49 -26.29 66.71 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.944 -0.302 . . . . 0.0 111.073 -179.096 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.449 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -132.08 0.29 3.8 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.501 179.204 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.3 m -110.95 148.35 32.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.159 0.504 . . . . 0.0 111.912 -178.75 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -143.47 157.79 44.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.081 -179.739 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 64.6 45.46 3.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.922 0.391 . . . . 0.0 110.884 -179.41 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.761 ' O ' HD22 ' A' ' 13' ' ' LEU . 68.1 m -69.54 136.29 51.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.777 179.893 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.24 150.51 42.73 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.318 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.476 ' CG1' HD13 ' A' ' 69' ' ' LEU . 35.2 mt -129.13 138.98 53.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.301 0.572 . . . . 0.0 111.631 179.93 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -136.27 110.22 8.22 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.374 179.265 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.85 -121.09 13.58 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.403 -0.903 . . . . 0.0 110.982 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.408 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 26.9 p -101.85 -5.7 24.47 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -179.259 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.556 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.5 t -101.03 141.28 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.075 0.465 . . . . 0.0 111.773 179.693 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.912 HD22 HD22 ' A' ' 37' ' ' LEU . 5.4 tp -103.96 126.63 51.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.565 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.586 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.5 m -116.05 125.88 53.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.325 -179.956 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.3 t -151.7 153.83 35.14 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.625 0.25 . . . . 0.0 111.336 -179.294 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.2 m -94.08 125.95 39.02 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.651 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 93.0 m -124.53 142.89 51.0 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -178.41 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -73.14 137.06 44.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.657 178.42 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -92.29 142.42 27.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.632 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 m -52.05 -29.23 20.37 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.476 -179.499 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -82.45 1.27 38.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.45 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.35 135.81 7.61 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.99 179.646 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.07 -169.89 13.14 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -131.27 142.66 50.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.32 0.56 . . . . 0.0 111.142 -179.899 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -153.84 128.18 9.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.029 -179.697 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 5.2 t -92.64 134.96 34.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.685 -179.028 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 64.1 p -121.33 158.38 28.35 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.375 179.954 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.0 m -122.83 144.81 48.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.976 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.686 HD11 ' CH2' ' A' ' 50' ' ' TRP . 12.0 tt -144.91 142.83 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.815 -179.818 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -95.3 115.46 27.46 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.93 179.597 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.579 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 14.9 mt -97.01 -5.29 38.06 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -179.343 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.954 ' ND2' HG22 ' A' ' 5' ' ' ILE . 9.0 t-20 -44.42 -28.95 0.62 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.447 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 64.5 m -82.23 -38.07 25.05 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.749 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 90' ' ' VAL . . . . . 0.726 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -74.09 -52.96 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -177.996 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.589 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.59 146.41 7.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.032 0.444 . . . . 0.0 111.292 -179.161 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 22.1 tt0 -137.38 167.07 22.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.077 -178.851 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -107.18 99.43 8.97 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.131 0.491 . . . . 0.0 110.501 -179.745 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.5 t -97.77 95.88 4.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.826 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.9 t0 54.16 33.8 18.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.659 0.266 . . . . 0.0 111.549 179.939 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.37 28.55 12.76 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.97 179.631 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.5 t -139.82 134.25 31.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.85 0.357 . . . . 0.0 111.187 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.414 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 71.8 mt -73.51 120.09 18.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.57 179.951 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . 0.409 ' O ' ' N ' ' A' ' 92' ' ' GLU . 18.8 mttt -124.93 130.95 53.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.565 -178.927 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 100' ' ' TYR . . . . . 0.487 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 26.3 t80 . . . . . 0 C--N 1.33 -0.252 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.365 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.226 0 N-CA-C 112.573 -0.211 . . . . 3.93 112.573 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.407 ' O ' ' O ' ' A' ' 89' ' ' SER . 2.8 tp -144.73 30.52 1.2 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.847 0.356 . . . . 2.57 110.956 -179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 143.84 -98.54 0.21 Allowed Glycine 0 C--N 1.329 0.175 0 N-CA-C 111.434 -0.666 . . . . 1.63 111.434 -179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.524 ' HA ' ' ND2' ' A' ' 88' ' ' ASN . 71.6 mttt 65.95 80.57 0.22 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.034 0.445 . . . . 1.82 111.68 179.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 33.5 p90 -92.25 -36.58 13.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.66 -0.7 . . . . 0.26 110.661 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.974 HG22 ' ND2' ' A' ' 88' ' ' ASN . 2.2 tp -63.03 -19.42 23.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 0.21 111.569 -179.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -75.65 -27.25 58.3 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 120.904 -0.318 . . . . 2.01 111.151 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 50.6 p -118.78 14.11 13.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.519 -0.31 . . . . 0.33 111.501 179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.2 m -129.67 151.32 50.4 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.067 0.461 . . . . 0.17 111.353 -179.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.62 172.83 12.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.715 -0.675 . . . . 2.56 110.723 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.44 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 4.9 p-10 49.16 56.05 8.38 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.211 -0.45 . . . . 1.24 111.875 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 3.1 p -79.19 134.1 36.69 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.733 -0.469 . . . . 0.34 109.733 178.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.757 ' O ' HD12 ' A' ' 19' ' ' LEU . 15.3 pt20 -157.26 163.41 38.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.125 -0.489 . . . . 1.35 111.511 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.68 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.35 136.56 37.65 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.713 -0.676 . . . . 0.09 110.958 -179.664 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.58 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.1 146.29 46.08 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.319 -0.855 . . . . 0.1 109.324 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.21 -152.64 24.5 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.002 -1.094 . . . . 0.11 111.438 -178.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.52 -36.41 18.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 117.014 0.407 . . . . 0.13 111.352 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.538 ' OG ' ' HB3' ' A' ' 38' ' ' ASP . 8.0 p -144.71 72.17 1.33 Allowed 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.509 -0.923 . . . . 0.16 108.509 179.357 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.58 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 4.5 mp0 -146.13 141.19 27.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.538 -0.756 . . . . 1.13 111.508 176.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.757 HD12 ' O ' ' A' ' 12' ' ' GLN . 21.2 tp -121.45 120.98 36.52 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.102 -0.703 . . . . 0.12 109.102 177.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.42 144.33 45.1 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.712 -0.477 . . . . 0.09 109.712 179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.56 172.51 16.24 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.061 -0.518 . . . . 0.1 110.729 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 60.1 mt-10 -112.83 133.25 54.91 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.163 -1.051 . . . . 1.58 108.163 176.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 59.0 m -131.0 136.39 48.46 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.228 0.537 . . . . 0.14 112.025 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 5.4 ptpt -68.03 135.22 51.94 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.465 -0.789 . . . . 0.79 111.632 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 31.7 p -87.03 -175.43 5.34 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.246 -0.888 . . . . 0.17 110.617 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.1 mmt180 -59.16 -33.73 71.26 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.604 0.594 . . . . 2.98 112.604 -178.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.45 11.67 8.2 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.554 0.576 . . . . 0.17 112.554 -178.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 67.09 41.86 2.51 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.589 0.709 . . . . 1.83 110.497 -178.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.479 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 11.5 mt-30 -116.68 132.63 56.64 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.692 -1.14 . . . . 1.92 108.513 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.408 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 77.4 m-85 -90.66 124.21 34.89 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.495 -0.482 . . . . 0.97 110.727 -179.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.7 m -122.29 160.89 23.89 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-O 120.974 0.416 . . . . 0.16 111.584 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.46 126.5 31.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.844 -0.616 . . . . 1.28 111.151 179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.5 t -140.42 157.46 45.5 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.327 -0.397 . . . . 0.13 110.779 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 36.2 ttpt -145.9 142.35 28.68 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.236 0.541 . . . . 1.6 112.106 -179.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.445 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.9 tp -118.57 126.62 75.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 115.367 -0.833 . . . . 0.11 108.77 178.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -87.3 118.64 26.87 Favored 'General case' 0 C--N 1.33 -0.253 0 O-C-N 122.271 -0.268 . . . . 0.95 110.672 -178.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.723 HD22 HD22 ' A' ' 69' ' ' LEU . 4.7 mp -87.56 -16.05 35.71 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.353 0.501 . . . . 0.11 112.353 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.538 ' HB3' ' OG ' ' A' ' 17' ' ' SER . 23.3 p30 -56.07 -45.38 79.33 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 112.582 0.586 . . . . 1.89 112.582 -177.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.533 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 2.5 p30 -91.37 -10.25 41.87 Favored 'General case' 0 C--N 1.33 -0.272 0 O-C-N 122.261 -0.274 . . . . 1.66 111.699 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -97.32 -64.21 1.06 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.747 -0.464 . . . . 0.24 109.747 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.487 HG13 HD23 ' A' ' 37' ' ' LEU . 25.6 mm -81.01 151.27 4.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.85 -0.614 . . . . 1.0 111.358 179.355 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.507 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.15 172.18 13.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.495 -0.775 . . . . 0.15 111.327 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.67 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 23.1 t30 -111.34 110.91 21.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.943 -0.571 . . . . 0.15 110.614 -179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.6 mm -110.39 92.34 2.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.947 -0.569 . . . . 1.0 112.004 -179.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 20.4 t0 62.65 37.18 13.06 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.777 0.323 . . . . 1.13 111.252 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.26 0.79 88.5 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.612 -0.804 . . . . 0.14 112.942 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 13.5 m -113.18 135.5 53.75 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.982 0.391 . . . . 0.2 110.649 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.401 HD12 ' OG ' ' A' ' 83' ' ' SER . 21.2 mt -77.04 118.72 19.88 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.604 0.716 . . . . 0.2 110.95 -178.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 30.0 mttt -137.15 162.51 33.23 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 114.654 -1.157 . . . . 1.33 110.042 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.798 ' CH2' HD11 ' A' ' 85' ' ' ILE . 9.7 m-90 -85.54 119.15 25.57 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.999 0.428 . . . . 0.26 111.466 -179.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.507 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 13.1 tt0 -174.9 141.22 0.69 Allowed Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.829 -0.623 . . . . 1.79 110.131 -179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -66.07 70.18 0.4 Allowed 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.195 1.93 . . . . 0.4 112.979 -178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.46 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.0 p -155.08 137.32 14.83 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.831 -1.077 . . . . 0.26 108.154 178.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.406 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.5 OUTLIER -80.95 104.2 11.3 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.097 0.777 . . . . 0.81 113.097 -176.806 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.528 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 44.2 p90 -51.9 -36.59 49.35 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.195 -0.911 . . . . 0.52 110.108 177.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 77.5 p -45.82 -25.1 0.46 Allowed 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 114.938 -1.028 . . . . 0.27 112.939 -178.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -66.27 -20.24 66.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.676 0.275 . . . . 1.73 111.352 -179.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.67 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 30.1 p -128.69 6.71 5.64 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.485 -0.325 . . . . 0.17 111.007 179.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.2 m -126.45 149.67 49.15 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.209 0.528 . . . . 0.1 111.703 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.3 p90 -142.42 157.86 44.32 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.319 -0.855 . . . . 0.96 109.817 -179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 54.1 m-20 63.38 46.65 4.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.096 0.474 . . . . 0.95 110.639 -179.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.68 ' O ' HD22 ' A' ' 13' ' ' LEU . 46.1 m -69.37 135.11 49.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.847 -0.615 . . . . 0.15 110.178 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.431 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -141.96 150.04 40.89 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.114 -0.493 . . . . 0.11 111.703 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.542 HG13 ' HB2' ' A' ' 13' ' ' LEU . 38.6 mt -130.45 142.44 43.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.222 0.534 . . . . 0.11 111.86 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -139.64 111.93 7.64 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.253 -0.885 . . . . 1.7 108.847 178.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.571 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 66.75 -122.97 21.32 Favored Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 120.242 -0.98 . . . . 0.12 111.58 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.602 ' N ' HD13 ' A' ' 5' ' ' ILE . 82.5 p -100.36 -5.64 26.99 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.492 0.553 . . . . 0.15 112.492 -178.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.479 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.6 t -102.8 139.87 22.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 121.052 0.453 . . . . 0.14 111.692 179.757 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.723 HD22 HD22 ' A' ' 37' ' ' LEU . 7.1 tp -102.25 126.95 49.39 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.824 -0.625 . . . . 0.12 110.89 -179.813 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.51 ' N ' HD12 ' A' ' 69' ' ' LEU . 4.5 m -116.04 123.99 49.32 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.962 -0.385 . . . . 0.14 109.962 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.425 ' O ' ' HA ' ' A' ' 82' ' ' THR . 11.2 t -151.54 153.38 34.43 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 121.253 -0.179 . . . . 0.12 111.245 -178.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.57 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 15.6 m -95.72 126.47 41.01 Favored 'General case' 0 CA--C 1.528 0.113 0 N-CA-C 109.832 -0.433 . . . . 0.15 109.832 178.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.427 ' HB3' ' OD1' ' A' ' 43' ' ' ASN . 72.3 m -126.87 145.85 50.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.361 0.6 . . . . 0.1 112.17 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.0 tt0 -74.96 139.08 42.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.167 -0.924 . . . . 1.26 111.113 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 43.1 mtp180 -91.32 145.0 25.01 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.915 -0.402 . . . . 3.35 109.915 179.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 34.9 m -51.46 -32.1 25.74 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 112.466 0.543 . . . . 0.26 112.466 -178.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.5 m-20 -83.58 4.6 27.52 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.04 0.385 . . . . 1.71 112.04 -179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.15 136.94 8.02 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.668 -0.777 . . . . 0.16 113.106 179.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 119.55 -174.58 15.52 Favored Glycine 0 N--CA 1.451 -0.337 0 N-CA-C 110.94 -0.864 . . . . 0.16 110.94 -178.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 56.5 m-85 -130.63 140.88 50.42 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 117.383 0.592 . . . . 0.75 111.032 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 49.6 t30 -154.16 131.04 10.88 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.139 -0.482 . . . . 1.16 110.421 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.57 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.3 t -93.71 134.67 35.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.135 -0.484 . . . . 0.15 111.118 -179.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.401 ' OG ' HD12 ' A' ' 48' ' ' LEU . 53.1 p -120.19 158.03 27.83 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.191 -0.459 . . . . 0.32 110.446 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.49 144.48 49.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.977 0.418 . . . . 1.07 111.045 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.798 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.0 tt -145.79 143.16 21.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.939 -0.573 . . . . 0.73 111.448 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -98.88 120.14 38.83 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.383 -0.371 . . . . 1.18 110.935 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.667 ' HB3' HD12 ' A' ' 91' ' ' ILE . 11.4 mt -100.28 -3.59 31.06 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.51 0.93 . . . . 0.19 113.51 -178.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.974 ' ND2' HG22 ' A' ' 5' ' ' ILE . 11.3 t-20 -44.69 -28.97 0.68 Allowed 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 118.038 0.381 . . . . 0.24 111.755 -178.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . 0.407 ' O ' ' O ' ' A' ' 1' ' ' LEU . 37.1 m -84.02 -39.3 19.81 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 112.575 0.583 . . . . 1.07 112.575 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.78 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.0 m -73.24 -49.22 39.2 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 112.946 0.721 . . . . 0.2 112.946 -178.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.667 HD12 ' HB3' ' A' ' 87' ' ' LEU . 2.7 mt -85.07 147.58 5.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.655 0.264 . . . . 0.14 110.662 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 23.5 tt0 -137.49 163.04 32.08 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.817 -0.438 . . . . 1.17 109.817 -179.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -107.12 100.23 9.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.22 0.533 . . . . 0.23 110.184 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 18.8 t -100.37 98.56 7.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.45 -0.795 . . . . 0.16 111.825 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.3 t0 53.44 33.66 16.47 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 112.108 0.41 . . . . 0.24 112.108 179.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.76 27.03 15.24 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 120.638 -0.792 . . . . 0.12 113.08 179.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -141.85 134.04 27.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.693 0.282 . . . . 1.23 110.95 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.487 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 62.6 mt -74.24 122.7 23.24 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.445 -0.343 . . . . 0.19 110.673 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 9.6 mttt -122.65 143.07 50.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.976 0.417 . . . . 1.5 111.488 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -90.0 78.57 6.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.924 -0.58 . . . . 1.44 110.734 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.192 -0.909 . . . . 3.84 110.849 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.154 0 N-CA-C 112.658 -0.177 . . . . 0.0 112.658 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 6.9 mt 61.39 32.35 19.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.762 0.315 . . . . 0.0 110.944 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 145.88 134.51 2.67 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.516 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.1 mmtp -154.12 84.38 1.14 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.622 0.249 . . . . 0.0 111.13 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.41 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 15.0 p90 -93.04 -40.75 10.35 Favored 'General case' 0 N--CA 1.465 0.296 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.893 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.0 tp -61.86 -21.28 25.6 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-O 120.609 0.242 . . . . 0.0 111.379 -179.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.49 -26.73 51.52 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.7 0.286 . . . . 0.0 110.615 179.05 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 71.0 p -118.75 18.73 13.32 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.814 179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.0 m -135.69 153.87 51.46 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.895 0.379 . . . . 0.0 111.165 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 ptm85 -131.46 172.72 11.87 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.994 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 48.87 58.14 5.65 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.621 HG21 ' CD1' ' A' ' 5' ' ' ILE . 43.9 p -79.46 134.31 36.53 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 178.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.603 ' O ' HD12 ' A' ' 19' ' ' LEU . 27.1 pt20 -158.09 163.68 37.4 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.605 -179.032 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.707 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.42 135.9 38.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.244 0.545 . . . . 0.0 110.944 -179.96 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.8 144.84 47.09 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.141 179.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.58 -152.8 29.93 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 119.739 -1.22 . . . . 0.0 111.486 -179.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.47 -36.86 18.8 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -178.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -140.86 35.74 1.77 Allowed 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 113.064 0.764 . . . . 0.0 113.064 -178.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -115.87 148.06 40.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.135 0.493 . . . . 0.0 111.951 178.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.806 ' CB ' HD11 ' A' ' 37' ' ' LEU . 8.6 tp -121.57 124.95 45.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.184 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.09 144.08 48.75 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.99 0.424 . . . . 0.0 110.206 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.55 172.47 16.32 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.851 -178.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 69.8 mt-10 -112.02 134.86 53.31 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 176.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 82.5 m -130.71 135.07 47.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.206 0.527 . . . . 0.0 112.337 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.06 135.15 53.22 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.438 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.474 HG22 ' O ' ' A' ' 95' ' ' ASP . 79.8 p -84.84 -177.7 6.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.366 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 31.9 mtp180 -60.37 -30.64 69.69 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.768 0.318 . . . . 0.0 111.361 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.06 10.34 8.31 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 66.41 36.05 5.37 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.11 0.481 . . . . 0.0 111.117 -178.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -115.94 136.32 53.15 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 177.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.5 m-85 -93.98 125.08 38.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.122 0.487 . . . . 0.0 112.19 -178.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.9 m -131.46 148.5 32.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.623 179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.4 m -69.85 136.59 50.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.219 0.533 . . . . 0.0 111.809 -178.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.9 t -143.24 161.64 37.75 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.03 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.2 ttpm? -142.92 156.89 44.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.483 0.658 . . . . 0.0 112.226 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.458 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -138.08 126.32 30.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 114.894 -1.048 . . . . 0.0 108.612 179.447 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -89.28 118.76 29.2 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.793 0.33 . . . . 0.0 110.761 -178.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.806 HD11 ' CB ' ' A' ' 19' ' ' LEU . 4.0 mp -87.99 -14.66 38.54 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.329 -0.396 . . . . 0.0 112.028 -179.773 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.438 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.9 p-10 -57.68 -44.39 85.76 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -178.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.438 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 5.9 p30 -92.6 -10.94 35.65 Favored 'General case' 0 N--CA 1.463 0.208 0 O-C-N 122.089 -0.382 . . . . 0.0 111.542 178.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.466 ' HB3' HD12 ' A' ' 41' ' ' ILE . 19.6 m-70 -96.69 -66.34 0.91 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.609 HD12 ' N ' ' A' ' 41' ' ' ILE . 2.1 mp -81.09 150.47 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.001 178.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.466 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.1 172.14 13.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.809 -178.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.462 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 20.1 t30 -112.75 111.56 22.43 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.323 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 41.4 mm -110.82 90.25 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.383 -179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.8 t70 66.93 38.97 3.44 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.932 -179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.01 5.38 89.34 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.638 -0.791 . . . . 0.0 112.778 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 25.4 m -115.96 135.23 54.17 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 116.912 0.356 . . . . 0.0 110.522 179.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 19.4 mt -77.39 118.84 20.24 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.688 0.756 . . . . 0.0 111.58 -177.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 29.8 mttt -137.97 162.95 32.74 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.493 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.734 ' CE2' HG11 ' A' ' 90' ' ' VAL . 8.5 m-90 -86.79 121.05 28.75 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.869 0.366 . . . . 0.0 111.28 -179.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.467 ' O ' ' N ' ' A' ' 53' ' ' SER . 32.4 tt0 -174.89 143.06 0.76 Allowed Pre-proline 0 N--CA 1.464 0.267 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.491 -179.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -62.98 68.37 0.14 Allowed 'Trans proline' 0 C--N 1.349 0.593 0 C-N-CA 122.336 2.024 . . . . 0.0 112.994 -179.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.467 ' N ' ' O ' ' A' ' 51' ' ' GLN . 4.7 p -158.96 131.73 6.97 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 178.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.422 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.71 109.96 15.74 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -177.543 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -48.0 -30.49 4.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.927 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 62.8 p -49.92 -19.04 0.61 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.823 0.675 . . . . 0.0 112.823 -179.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 53.5 mm-40 -61.43 -29.41 69.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.576 0.227 . . . . 0.0 110.895 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.462 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -127.95 0.3 5.95 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.537 179.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -113.09 148.09 35.97 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.39 0.614 . . . . 0.0 112.295 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -142.07 157.58 44.75 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.831 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 64.02 44.87 4.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.99 0.424 . . . . 0.0 110.342 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.707 ' O ' HD22 ' A' ' 13' ' ' LEU . 10.2 m -69.16 138.17 53.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.5 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -145.28 153.21 41.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.529 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.406 ' CD1' ' HB2' ' A' ' 19' ' ' LEU . 27.5 mt -129.55 139.4 51.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.193 0.521 . . . . 0.0 111.537 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 9.6 mm-40 -133.39 107.92 8.37 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.172 179.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.15 -119.73 11.03 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.44 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.2 p -102.91 -3.08 26.69 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 117.004 0.402 . . . . 0.0 111.87 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.46 HG13 ' O ' ' A' ' 85' ' ' ILE . 8.0 t -102.32 138.87 24.96 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-O 121.097 0.475 . . . . 0.0 111.962 -179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.713 HD22 HD22 ' A' ' 37' ' ' LEU . 3.1 tp -100.43 126.17 46.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.914 179.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.663 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.4 m -116.85 124.41 49.45 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.231 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.3 t -152.37 153.85 34.45 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 111.723 0.268 . . . . 0.0 111.723 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 10.4 m -93.41 125.9 38.26 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 177.818 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 90.8 m -124.91 143.95 50.59 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -178.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . 0.413 ' HG3' ' CE1' ' A' ' 80' ' ' TYR . 16.2 tt0 -74.34 136.14 42.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.894 178.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 6.4 mtm180 -91.83 142.55 27.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.685 0.279 . . . . 0.0 110.68 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.8 m -51.9 -27.09 11.73 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.7 -179.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -83.12 2.59 34.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.786 0.327 . . . . 0.0 111.284 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.86 135.85 6.49 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.542 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.27 -170.03 13.11 Favored Glycine 0 C--N 1.318 -0.418 0 N-CA-C 110.841 -0.904 . . . . 0.0 110.841 -178.502 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.413 ' CE1' ' HG3' ' A' ' 74' ' ' GLU . 18.3 m-85 -131.86 143.18 49.98 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 117.411 0.605 . . . . 0.0 111.56 -179.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 45.8 t30 -153.94 130.07 10.36 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.471 -179.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.491 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.6 t -91.86 135.3 34.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.686 -179.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 85.9 p -124.23 158.05 33.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.256 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.75 144.41 49.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.844 0.354 . . . . 0.0 111.092 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.729 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.5 tt -144.71 142.56 23.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.291 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -97.63 117.79 32.71 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.646 179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.613 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 5.8 mt -98.54 -5.16 32.66 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -178.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.893 ' ND2' HG22 ' A' ' 5' ' ' ILE . 7.5 t-20 -45.37 -27.99 0.78 Allowed 'General case' 0 N--CA 1.471 0.585 0 O-C-N 122.151 -0.343 . . . . 0.0 111.754 -178.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.71 -40.38 25.43 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.734 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.3 m -73.47 -53.15 18.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -178.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.598 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.1 mp -80.85 147.95 5.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.972 0.415 . . . . 0.0 111.202 -179.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.418 ' N ' ' O ' ' A' ' 99' ' ' LYS . 15.2 tt0 -138.07 164.63 28.62 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.926 -0.579 . . . . 0.0 109.838 -178.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.3 t30 -106.42 99.66 9.23 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.309 0.576 . . . . 0.0 110.365 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 39.2 t -98.98 97.14 5.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 115.353 -0.839 . . . . 0.0 110.92 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.474 ' O ' HG22 ' A' ' 25' ' ' THR . 23.2 t0 53.98 31.8 14.19 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.68 0.276 . . . . 0.0 111.565 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.11 28.22 11.15 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.794 -0.717 . . . . 0.0 113.414 179.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 42.5 m -139.76 136.35 34.03 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.882 0.372 . . . . 0.0 111.138 179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.409 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 77.0 mt -74.04 119.36 18.15 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.648 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.418 ' O ' ' N ' ' A' ' 92' ' ' GLU . 4.1 mmmt -125.99 137.14 53.65 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.984 0.421 . . . . 0.0 111.966 -179.136 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.45 ' CD2' ' CE1' ' A' ' 40' ' ' HIS . 19.5 t80 -78.41 148.81 33.49 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.314 179.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.432 ' N ' ' CD1' ' A' ' 100' ' ' TYR . 23.5 tt0 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.309 -0.853 . . . . 0.0 111.031 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.258 0 N-CA-C 112.494 -0.243 . . . . 0.0 112.494 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.507 ' O ' HD23 ' A' ' 1' ' ' LEU . 2.3 tt -153.78 -47.3 0.09 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.738 0.304 . . . . 0.0 111.018 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 149.07 123.46 1.27 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.642 -0.79 . . . . 0.0 112.804 179.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt -151.89 84.39 1.28 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.851 0.358 . . . . 0.0 110.711 179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.453 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 16.1 p90 -88.45 -42.32 12.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.545 -179.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.942 HG22 ' ND2' ' A' ' 88' ' ' ASN . 6.4 tp -62.24 -21.27 26.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 120.615 0.245 . . . . 0.0 111.389 -179.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -76.66 -27.33 55.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.742 0.306 . . . . 0.0 111.033 179.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 50.1 p -118.9 18.37 13.26 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.664 179.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 77.8 m -131.42 155.08 47.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.057 0.456 . . . . 0.0 111.545 -179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -132.51 172.95 11.84 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.889 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.0 p30 48.82 58.1 5.68 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.566 HG21 ' CD1' ' A' ' 5' ' ' ILE . 40.2 p -79.49 130.77 35.71 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 178.354 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.653 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.4 pt20 -157.05 163.26 39.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.417 -179.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.747 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.86 136.42 38.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.822 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.45 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.06 145.52 46.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.345 179.24 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.27 -152.28 33.78 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.788 -1.196 . . . . 0.0 111.325 -178.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.19 -37.17 18.97 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 -178.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.461 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.63 35.36 1.63 Allowed 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.45 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.8 OUTLIER -113.71 147.9 37.36 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.937 0.399 . . . . 0.0 111.662 179.016 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.819 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.4 tp -120.11 123.61 43.78 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.397 179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.63 143.69 48.54 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.49 172.51 16.3 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.214 -178.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -110.07 134.12 52.49 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 176.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.484 ' SG ' HD21 ' A' ' 98' ' ' LEU . 75.0 m -130.67 132.91 45.68 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.385 -0.526 . . . . 0.0 112.082 -178.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.5 ptpt -66.93 136.33 55.2 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.357 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.413 HG22 ' O ' ' A' ' 95' ' ' ASP . 71.2 p -85.21 -176.91 6.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.49 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -62.29 -29.71 70.62 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.229 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.96 10.35 8.1 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 -178.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.8 mt-30 66.9 38.36 3.68 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.12 0.486 . . . . 0.0 111.511 -178.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.466 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 3.0 mm-40 -118.28 135.92 54.0 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.513 -0.767 . . . . 0.0 108.979 178.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -93.07 124.85 37.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.8 0.333 . . . . 0.0 111.444 -178.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.5 m -130.99 151.78 36.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.896 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 17.8 p -71.5 134.29 46.43 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.173 0.511 . . . . 0.0 111.916 -178.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 t -144.17 161.37 39.04 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.368 179.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -143.7 156.64 44.6 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.298 0.571 . . . . 0.0 111.893 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.485 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -136.57 127.59 42.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 115.302 -0.863 . . . . 0.0 108.977 179.608 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -87.49 116.98 25.98 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 120.699 0.285 . . . . 0.0 111.531 -178.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.897 HD22 HD22 ' A' ' 69' ' ' LEU . 3.9 mp -87.59 -14.84 39.05 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.91 179.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.433 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -56.59 -48.24 77.82 Favored 'General case' 0 CA--C 1.531 0.248 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -178.297 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.419 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -90.96 -10.08 43.68 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 122.13 -0.356 . . . . 0.0 111.384 179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.9 m-70 -95.21 -62.98 1.21 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.603 HD11 HD22 ' A' ' 87' ' ' LEU . 22.7 mm -80.73 151.04 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.839 178.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.56 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.91 172.23 12.97 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.107 -179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.485 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 34.3 t30 -112.18 108.85 18.25 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.682 -179.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 50.8 mm -109.64 89.78 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.315 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 43.9 t0 66.21 38.05 4.76 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.332 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.25 0.63 88.55 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.182 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.4 m -112.08 137.36 50.24 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.924 0.393 . . . . 0.0 111.003 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 26.8 mt -76.95 117.5 18.6 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.705 0.764 . . . . 0.0 111.565 -177.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.7 mttm -138.44 162.86 33.38 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 114.443 -1.253 . . . . 0.0 109.836 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.803 ' CH2' HD11 ' A' ' 85' ' ' ILE . 4.0 m-90 -84.86 123.13 30.12 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.039 0.447 . . . . 0.0 111.865 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.56 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -172.17 147.17 1.8 Allowed Pre-proline 0 C--N 1.331 -0.196 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.255 -179.739 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.419 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 51.6 Cg_endo -69.65 63.7 1.73 Allowed 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 122.231 1.954 . . . . 0.0 112.305 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.402 ' O ' ' O ' ' A' ' 41' ' ' ILE . 3.1 p -158.28 135.15 9.79 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 114.93 -1.032 . . . . 0.0 108.32 179.111 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.01 109.71 15.86 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -177.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.461 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 37.6 p90 -48.92 -29.4 4.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.466 178.28 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.3 p -48.31 -17.89 0.18 Allowed 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.883 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -63.75 -29.01 70.27 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.623 0.249 . . . . 0.0 111.39 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.485 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -127.51 -0.94 6.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.473 179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.7 m -110.53 147.97 33.08 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.202 0.525 . . . . 0.0 111.931 -178.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.7 p90 -142.29 157.61 44.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.045 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 6.6 m120 64.14 47.29 3.33 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.947 0.403 . . . . 0.0 110.856 -179.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.747 ' O ' HD22 ' A' ' 13' ' ' LEU . 6.1 m -70.79 135.03 47.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.689 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.12 150.36 42.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.575 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.497 HG13 ' HB2' ' A' ' 13' ' ' LEU . 33.6 mt -128.68 138.76 53.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.376 0.608 . . . . 0.0 111.891 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 -136.09 108.19 7.21 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.16 -0.927 . . . . 0.0 108.963 178.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.441 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 69.53 -121.36 11.01 Favored Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.442 -0.885 . . . . 0.0 111.449 -178.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.45 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.2 p -101.68 -4.17 26.98 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -179.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.52 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.2 t -101.41 140.37 20.28 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 121.033 0.444 . . . . 0.0 111.99 -179.799 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.897 HD22 HD22 ' A' ' 37' ' ' LEU . 7.7 tp -102.49 125.97 49.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.022 -0.536 . . . . 0.0 110.349 179.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.504 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -116.11 124.69 51.0 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.5 t -151.79 153.77 34.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.704 0.287 . . . . 0.0 111.485 -178.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 18.8 m -94.83 126.22 40.01 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 178.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 88.1 m -125.95 144.98 50.47 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.351 0.596 . . . . 0.0 112.37 -178.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -74.26 137.43 42.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.914 178.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -91.93 142.5 27.48 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.665 0.269 . . . . 0.0 110.446 179.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 56.4 m -52.14 -26.8 12.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.539 -179.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -83.43 2.03 38.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.579 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.45 134.99 6.87 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.852 -0.689 . . . . 0.0 112.774 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.09 -169.14 12.76 Favored Glycine 0 C--N 1.319 -0.41 0 N-CA-C 111.138 -0.785 . . . . 0.0 111.138 -178.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -131.04 143.31 50.6 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 117.337 0.568 . . . . 0.0 111.308 -179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -153.9 128.85 9.53 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.167 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.7 t -91.97 134.71 34.55 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.495 -179.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 21.8 p -121.96 158.03 29.97 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.276 179.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 23.6 p -123.2 145.02 48.99 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.878 0.371 . . . . 0.0 110.978 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.803 HD11 ' CH2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -146.99 145.03 19.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.628 -179.822 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.776 ' N ' HD13 ' A' ' 85' ' ' ILE . 46.1 t0 -98.56 117.91 34.07 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.244 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.603 HD22 HD11 ' A' ' 41' ' ' ILE . 6.3 mt -100.1 -6.47 26.26 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.942 ' ND2' HG22 ' A' ' 5' ' ' ILE . 7.0 t-20 -45.01 -27.04 0.5 Allowed 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -178.392 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.7 m -80.26 -38.34 31.11 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.669 HG11 ' CZ2' ' A' ' 50' ' ' TRP . 3.2 m -75.49 -51.83 19.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -178.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.531 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -81.57 147.49 6.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 121.034 0.445 . . . . 0.0 111.247 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.44 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 23.1 tt0 -139.08 167.0 23.04 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.266 -178.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -106.26 99.56 9.14 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.18 0.514 . . . . 0.0 110.378 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.404 ' CG2' ' HG3' ' A' ' 99' ' ' LYS . 58.6 t -97.95 96.51 5.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.999 179.521 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.413 ' O ' HG22 ' A' ' 25' ' ' THR . 28.5 t0 53.45 32.84 14.73 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.632 0.253 . . . . 0.0 111.515 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.44 28.38 11.59 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.831 -0.7 . . . . 0.0 113.345 179.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.7 m -141.1 135.06 30.58 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.791 0.329 . . . . 0.0 111.009 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.484 HD21 ' SG ' ' A' ' 23' ' ' CYS . 54.1 mt -73.39 119.94 18.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.759 -179.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.3 mttm -123.81 133.95 53.71 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.467 -179.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.404 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 36.6 t80 -79.0 -32.06 45.01 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.34 179.559 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 . . . . . 0 C--O 1.248 1.014 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.871 179.785 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.16 0 N-CA-C 112.436 -0.265 . . . . 0.0 112.436 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 16.5 tp -144.17 108.72 4.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.82 0.343 . . . . 0.0 110.81 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 82.28 -106.31 2.68 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.808 179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.6 mmtm 62.48 66.46 0.78 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.841 0.353 . . . . 0.0 110.988 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.46 ' CE2' ' HA ' ' A' ' 88' ' ' ASN . 22.8 p90 -91.39 -40.39 11.47 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.617 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.961 HG22 ' ND2' ' A' ' 88' ' ' ASN . 3.8 tp -64.43 -18.16 22.54 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.674 0.274 . . . . 0.0 111.272 -179.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.31 -24.19 60.36 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.873 0.368 . . . . 0.0 110.577 179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 76.4 p -118.46 -3.77 10.9 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.682 179.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.8 m -108.19 152.58 24.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.966 0.412 . . . . 0.0 111.482 -179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -132.09 172.42 12.4 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.751 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.403 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 6.2 p-10 48.43 58.05 5.6 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.799 HG21 ' CD1' ' A' ' 5' ' ' ILE . 66.9 p -79.67 132.75 36.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.319 178.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.629 ' O ' HD12 ' A' ' 19' ' ' LEU . 19.6 pt20 -158.71 163.95 36.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.192 -179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.692 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.42 136.38 37.95 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.147 0.499 . . . . 0.0 110.863 -179.666 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.22 143.81 47.07 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.098 179.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.29 -152.78 32.9 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 119.89 -1.147 . . . . 0.0 111.462 -179.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -85.83 -37.09 19.59 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -178.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.458 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -141.43 36.23 1.67 Allowed 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 8.2 mp0 -115.83 146.67 41.78 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.808 0.337 . . . . 0.0 111.81 178.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.764 ' CB ' HD11 ' A' ' 37' ' ' LEU . 10.7 tp -119.86 124.76 46.86 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 178.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.21 142.66 47.81 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.2 172.72 16.21 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.189 -178.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -115.45 133.54 55.93 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 177.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 34.7 m -130.77 135.66 47.98 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.077 0.465 . . . . 0.0 111.62 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.7 ptpt -66.88 136.93 56.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.675 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.637 HG22 ' O ' ' A' ' 95' ' ' ASP . 42.4 p -84.91 -176.92 6.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.505 -0.771 . . . . 0.0 110.696 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 3.8 mmt-85 -61.48 -30.48 70.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.801 0.334 . . . . 0.0 110.995 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.12 9.17 9.05 Favored 'General case' 0 C--N 1.33 -0.283 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -178.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 66.99 38.81 3.42 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.317 0.579 . . . . 0.0 111.099 -178.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.434 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 60.8 mt-30 -119.42 134.89 54.99 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.283 -0.872 . . . . 0.0 108.872 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.406 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 43.4 m-85 -93.09 124.65 37.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.972 0.415 . . . . 0.0 111.544 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.1 m -130.36 153.58 39.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.811 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.24 134.46 44.29 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.27 0.557 . . . . 0.0 112.186 -178.478 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.8 t -143.59 161.21 39.08 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 115.264 -0.88 . . . . 0.0 110.28 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.0 ttmt -142.86 156.73 44.98 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.341 0.591 . . . . 0.0 111.887 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.482 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.03 128.05 49.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.017 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -88.33 115.42 25.82 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.626 0.25 . . . . 0.0 111.296 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.967 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -86.59 -15.44 39.82 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.344 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.422 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -57.09 -45.22 83.53 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.711 0.263 . . . . 0.0 111.711 -178.757 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -91.89 -10.41 39.73 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.477 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 26.8 m-70 -98.33 -63.33 1.14 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.533 HD13 ' CD1' ' A' ' 50' ' ' TRP . 20.6 mm -80.6 147.73 6.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.952 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.44 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.07 172.24 12.95 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.526 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.473 ' C ' HD12 ' A' ' 44' ' ' ILE . 25.9 t30 -113.11 111.72 22.61 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.164 -179.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.78 HD13 ' HB2' ' A' ' 49' ' ' LYS . 3.0 mp -112.01 89.34 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 120.909 0.385 . . . . 0.0 111.032 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.7 t0 67.78 38.26 2.97 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.258 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.75 0.88 87.57 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.564 -0.827 . . . . 0.0 113.424 179.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.4 m -110.72 135.41 51.36 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 117.307 0.554 . . . . 0.0 110.893 179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 29.7 mt -77.63 118.76 20.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.454 0.645 . . . . 0.0 111.249 -178.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.78 ' HB2' HD13 ' A' ' 44' ' ' ILE . 28.2 mttt -138.99 163.24 32.89 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 114.856 -1.065 . . . . 0.0 110.514 -179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.727 ' CE2' HG11 ' A' ' 90' ' ' VAL . 7.7 m-90 -85.89 118.68 25.52 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.133 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.44 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 43.0 tt0 -174.66 143.14 0.8 Allowed Pre-proline 0 N--CA 1.465 0.31 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.005 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.403 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 28.4 Cg_endo -64.55 74.67 0.2 Allowed 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.093 1.862 . . . . 0.0 113.164 -178.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -165.75 135.19 3.35 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 114.936 -1.029 . . . . 0.0 108.348 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.464 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.69 109.31 15.98 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 112.545 0.572 . . . . 0.0 112.545 -177.688 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 38.6 p90 -50.0 -28.41 6.88 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.808 178.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.1 p -49.32 -16.99 0.21 Allowed 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -63.92 -29.62 70.78 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 122.16 -0.338 . . . . 0.0 111.351 -178.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.458 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -128.2 1.04 5.8 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 121.073 -0.251 . . . . 0.0 111.479 179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.4 m -111.81 147.66 35.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.231 0.538 . . . . 0.0 112.095 -178.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -143.63 157.72 44.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.886 -179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.4 m-80 64.15 46.33 3.69 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 121.029 0.442 . . . . 0.0 110.89 -179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.692 ' O ' HD22 ' A' ' 13' ' ' LEU . 35.8 m -70.53 137.6 50.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.097 -179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.66 151.67 41.64 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.986 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.477 HG21 HD13 ' A' ' 19' ' ' LEU . 54.4 mt -130.66 138.77 52.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 121.325 0.583 . . . . 0.0 111.889 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -136.03 111.26 9.02 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.14 -0.936 . . . . 0.0 109.273 179.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.484 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.82 -121.1 13.65 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.122 -1.037 . . . . 0.0 110.734 -178.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.418 ' HB3' ' HB ' ' A' ' 5' ' ' ILE . 22.5 p -103.07 -3.21 26.25 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -179.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.471 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.6 t -100.97 138.19 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.252 0 CA-C-O 121.028 0.442 . . . . 0.0 111.937 179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.967 HD22 HD22 ' A' ' 37' ' ' LEU . 6.8 tp -102.49 124.37 47.93 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.142 179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.465 ' N ' HD12 ' A' ' 69' ' ' LEU . 4.5 m -115.67 126.92 54.75 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 t -152.01 153.86 34.85 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.768 0.318 . . . . 0.0 111.455 -179.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.2 m -93.9 126.13 38.92 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.0 m -126.88 144.93 50.84 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.467 0.651 . . . . 0.0 112.508 -178.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.4 tt0 -74.64 137.32 42.15 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.605 178.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -90.73 144.72 25.44 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 110.317 -0.253 . . . . 0.0 110.317 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.7 m -51.46 -26.46 8.23 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -178.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -83.17 3.07 32.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.634 0.254 . . . . 0.0 111.489 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.32 138.47 7.34 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.089 -179.556 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.77 -169.83 13.09 Favored Glycine 0 C--N 1.318 -0.448 0 N-CA-C 111.47 -0.652 . . . . 0.0 111.47 -178.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -129.5 140.42 51.27 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 117.196 0.498 . . . . 0.0 111.066 -179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -154.01 128.93 9.49 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.406 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.6 t -93.41 134.87 35.2 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.916 -179.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 37.6 p -121.98 158.3 29.41 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.516 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -122.12 144.52 48.89 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.662 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.653 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.6 tt -145.67 142.58 21.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.605 179.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -97.38 121.11 38.91 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.078 179.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.564 ' HB3' HD12 ' A' ' 91' ' ' ILE . 10.2 mt -100.58 -4.16 29.1 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.961 ' ND2' HG22 ' A' ' 5' ' ' ILE . 13.1 t-20 -44.75 -28.44 0.63 Allowed 'General case' 0 N--CA 1.468 0.436 0 O-C-N 122.097 -0.377 . . . . 0.0 111.756 -178.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 49.1 m -81.64 -41.78 20.95 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.727 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.3 m -72.13 -52.75 22.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -177.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.564 HD12 ' HB3' ' A' ' 87' ' ' LEU . 2.6 mp -81.99 145.49 8.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.108 0.48 . . . . 0.0 111.47 -178.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.4 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 9.1 tt0 -135.96 166.25 23.76 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.062 -178.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -107.95 99.53 8.98 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.27 0.557 . . . . 0.0 110.169 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.2 t -97.63 96.68 5.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.693 179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.637 ' O ' HG22 ' A' ' 25' ' ' THR . 22.1 t0 53.42 33.18 15.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.613 0.244 . . . . 0.0 111.599 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.12 28.52 11.67 Favored Glycine 0 C--N 1.33 0.236 0 C-N-CA 120.659 -0.781 . . . . 0.0 113.508 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.2 t -140.55 135.33 31.74 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.901 0.351 . . . . 0.0 110.875 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.429 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 55.6 mt -74.27 120.47 19.88 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.869 -179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -127.01 138.09 53.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.892 -179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.477 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 15.0 t80 -86.68 133.06 33.72 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.896 -0.593 . . . . 0.0 109.845 179.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.146 -0.931 . . . . 0.0 111.269 -179.46 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 N-CA-C 112.514 -0.234 . . . . 0.0 112.514 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 8.1 tp -100.1 159.62 14.96 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.748 0.309 . . . . 0.0 110.759 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -63.18 140.62 45.41 Favored Glycine 0 CA--C 1.518 0.231 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.864 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.72 83.77 1.29 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.734 0.302 . . . . 0.0 110.88 179.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.448 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 17.0 p90 -90.97 -41.85 10.88 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.704 -179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.952 HG22 ' ND2' ' A' ' 88' ' ' ASN . 6.8 tp -61.83 -22.56 28.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-O 120.679 0.276 . . . . 0.0 111.498 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -75.24 -24.53 57.68 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.63 -0.259 . . . . 0.0 111.069 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.8 p -118.05 -3.69 11.09 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -179.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 58.2 m -111.14 155.17 23.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.882 0.373 . . . . 0.0 111.069 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -130.22 172.43 11.81 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.79 179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 5.9 p-10 48.08 59.52 4.19 Favored 'General case' 0 N--CA 1.462 0.162 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.763 HG21 ' CD1' ' A' ' 5' ' ' ILE . 16.6 p -78.78 132.21 36.82 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.766 ' O ' HD12 ' A' ' 19' ' ' LEU . 18.4 pt20 -157.43 163.62 38.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.938 0.399 . . . . 0.0 111.79 -179.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.743 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.47 136.49 37.83 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.706 179.601 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.86 146.48 46.53 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.223 179.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.64 -153.15 25.12 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 119.771 -1.204 . . . . 0.0 111.365 -178.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.7 m -85.52 -36.95 20.18 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -178.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.0 p -140.81 36.11 1.79 Allowed 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -178.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 5.0 mp0 -115.23 149.64 37.41 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.153 0.501 . . . . 0.0 112.172 179.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.801 ' CB ' HD11 ' A' ' 37' ' ' LEU . 19.4 tp -122.45 123.06 40.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.239 178.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.461 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . . . -119.02 143.98 46.79 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 179.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.47 172.82 15.79 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.302 -178.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -110.98 133.99 52.95 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 61.4 m -130.8 132.08 45.04 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.052 0.453 . . . . 0.0 111.92 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.11 137.0 56.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.411 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.421 HG22 ' O ' ' A' ' 95' ' ' ASP . 53.3 p -87.3 -177.74 6.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.516 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.9 mmt85 -62.2 -28.94 70.03 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.557 0.218 . . . . 0.0 111.288 -179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.36 8.39 9.34 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 66.66 38.0 4.15 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-O 121.263 0.554 . . . . 0.0 110.653 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -118.88 136.08 54.23 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.977 178.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 29.5 m-85 -92.69 124.74 36.92 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.931 0.396 . . . . 0.0 111.452 -178.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 21.2 m -129.81 148.67 33.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.417 179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 8.5 t -71.61 137.15 47.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.179 0.514 . . . . 0.0 111.946 -178.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.2 t -145.97 162.35 38.01 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.643 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.461 ' HG3' ' HB2' ' A' ' 20' ' ' ALA . 28.8 ttpt -143.88 155.84 44.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.316 0.579 . . . . 0.0 112.043 -179.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.463 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.26 127.77 47.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 N-CA-C 108.439 -0.948 . . . . 0.0 108.439 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -89.1 118.6 28.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.72 0.295 . . . . 0.0 110.863 -177.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.801 HD11 ' CB ' ' A' ' 19' ' ' LEU . 3.7 mp -88.96 -16.11 32.57 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.852 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.401 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.1 p-10 -56.57 -43.93 80.47 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 -178.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.401 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.3 OUTLIER -92.71 -10.59 36.58 Favored 'General case' 0 N--CA 1.467 0.396 0 O-C-N 122.201 -0.312 . . . . 0.0 111.601 178.92 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.6 m-70 -96.65 -64.92 1.0 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.626 HD11 HD22 ' A' ' 87' ' ' LEU . 23.2 mm -80.93 148.49 5.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.734 178.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -138.52 172.26 13.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.84 -179.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.412 ' HB2' ' CB ' ' A' ' 55' ' ' PHE . 30.0 t30 -111.96 109.59 19.45 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.464 -179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 37.8 mm -109.54 88.98 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.678 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 49.8 t0 67.17 39.68 3.03 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.255 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.48 0.75 88.11 Favored Glycine 0 CA--C 1.52 0.39 0 C-N-CA 120.829 -0.7 . . . . 0.0 113.439 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 39.1 m -113.78 138.23 50.54 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.033 0.444 . . . . 0.0 111.429 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.6 mt -77.17 117.17 18.45 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.645 0.736 . . . . 0.0 111.118 -178.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 46.4 mttt -135.84 162.49 32.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 114.763 -1.108 . . . . 0.0 109.859 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.825 ' CH2' HD11 ' A' ' 85' ' ' ILE . 4.9 m-90 -85.33 118.04 24.63 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.966 0.412 . . . . 0.0 111.149 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.417 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 29.2 tt0 -173.04 142.25 1.02 Allowed Pre-proline 0 N--CA 1.465 0.324 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.705 -179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.4 ' HD2' ' HG3' ' A' ' 51' ' ' GLN . 34.3 Cg_endo -64.97 73.29 0.23 Allowed 'Trans proline' 0 C--N 1.349 0.582 0 C-N-CA 121.968 1.779 . . . . 0.0 112.455 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.408 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -162.85 134.57 5.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.819 -1.082 . . . . 0.0 108.69 179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -82.23 109.34 16.42 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.412 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 29.8 p90 -48.5 -30.74 5.5 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.876 178.477 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.2 p -49.14 -17.82 0.26 Allowed 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -178.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.4 mm100 -62.02 -28.66 69.74 Favored 'General case' 0 N--CA 1.462 0.152 0 C-N-CA 120.926 -0.31 . . . . 0.0 111.136 -179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.412 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.5 p -128.56 -0.09 5.55 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 121.174 -0.21 . . . . 0.0 111.387 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.2 m -110.69 148.8 31.52 Favored 'General case' 0 C--O 1.232 0.173 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 11.5 p90 -141.1 156.97 45.9 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 115.263 -0.881 . . . . 0.0 110.248 179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 96.0 m-20 62.96 46.53 4.79 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.98 0.419 . . . . 0.0 110.632 -179.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.743 ' O ' HD22 ' A' ' 13' ' ' LEU . 73.0 m -69.31 135.96 51.15 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.188 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.403 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -143.16 152.57 41.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.673 -179.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.52 HD13 HD13 ' A' ' 19' ' ' LEU . 52.4 mt -129.83 140.1 49.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 121.284 0.564 . . . . 0.0 111.905 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -135.23 108.83 7.94 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.257 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.449 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.18 -120.95 14.55 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.445 -0.883 . . . . 0.0 111.012 -178.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.455 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.5 p -100.85 -3.17 30.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 117.144 0.472 . . . . 0.0 111.858 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.568 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.3 t -101.95 138.51 25.95 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-O 121.01 0.433 . . . . 0.0 111.922 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.784 HD22 HD22 ' A' ' 37' ' ' LEU . 6.6 tp -101.13 124.92 47.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.394 179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.462 ' N ' HD12 ' A' ' 69' ' ' LEU . 2.9 m -115.16 125.12 53.05 Favored 'General case' 0 N--CA 1.461 0.103 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 12.2 t -151.94 154.09 35.38 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.895 -0.322 . . . . 0.0 111.616 -179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.9 m -93.88 125.81 38.72 Favored 'General case' 0 C--N 1.332 -0.156 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 84.8 m -127.95 145.3 51.01 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 -178.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -75.63 136.47 40.46 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 115.169 -0.923 . . . . 0.0 110.585 178.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 57.4 mtp180 -92.21 146.01 24.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.591 -0.277 . . . . 0.0 110.669 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.3 m -51.79 -27.38 12.12 Favored 'General case' 0 N--CA 1.462 0.155 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -82.95 2.3 35.38 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.524 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 89.95 137.79 6.83 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.417 -179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.19 -169.46 12.89 Favored Glycine 0 C--N 1.319 -0.396 0 N-CA-C 111.121 -0.792 . . . . 0.0 111.121 -178.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -132.03 142.18 49.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.282 0.541 . . . . 0.0 111.15 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 7.4 t-20 -154.32 128.28 8.87 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.124 179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.473 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.0 OUTLIER -91.61 134.16 34.92 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.264 -179.479 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 p -119.29 158.27 26.39 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.588 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 4.4 p -120.15 142.75 48.66 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.818 179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.841 HD13 ' N ' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -148.07 144.95 18.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.529 179.736 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.841 ' N ' HD13 ' A' ' 85' ' ' ILE . 11.0 t70 -100.79 120.73 40.54 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.585 -179.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.626 HD22 HD11 ' A' ' 41' ' ' ILE . 12.1 mt -102.02 -3.25 27.98 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -179.131 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.952 ' ND2' HG22 ' A' ' 5' ' ' ILE . 6.3 t-20 -45.0 -26.96 0.49 Allowed 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 -178.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 6.2 m -80.22 -42.17 23.79 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.684 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.7 m -71.63 -52.9 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -178.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.653 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.2 mp -80.53 147.68 6.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 120.945 0.402 . . . . 0.0 111.342 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.413 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 12.9 tt0 -139.46 167.2 22.63 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.473 -178.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 42.1 t-20 -105.8 99.5 9.1 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.997 0.427 . . . . 0.0 110.639 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 40.2 t -100.34 94.87 3.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.787 179.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.421 ' O ' HG22 ' A' ' 25' ' ' THR . 20.5 t0 55.36 32.58 19.06 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.674 0.273 . . . . 0.0 111.448 -179.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.28 27.87 14.57 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.915 -0.659 . . . . 0.0 113.204 179.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.3 t -139.05 134.02 32.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.73 0.3 . . . . 0.0 111.059 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.425 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 78.2 mt -72.74 118.78 16.09 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.945 -179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 5.1 mttm -124.74 140.5 52.88 Favored 'General case' 0 N--CA 1.463 0.185 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -84.8 143.46 29.09 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.014 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.32 -0.848 . . . . 0.0 110.811 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.221 0 N-CA-C 112.472 -0.251 . . . . 0.0 112.472 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 31.9 mt -62.53 -52.0 65.18 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.77 0.319 . . . . 0.0 110.86 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.54 -82.64 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.662 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.5 mmtt 65.92 70.71 0.43 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.968 0.413 . . . . 0.0 110.681 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.44 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 18.3 p90 -91.85 -38.75 12.14 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.349 -179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.952 HG22 ' ND2' ' A' ' 88' ' ' ASN . 6.7 tp -66.24 -13.18 15.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.712 0.264 . . . . 0.0 111.712 -179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.2 mm-40 -77.54 -26.82 51.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.891 0.377 . . . . 0.0 110.878 179.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.2 p -118.56 0.34 11.53 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.528 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 76.0 m -112.31 153.44 27.21 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 121.015 0.436 . . . . 0.0 111.047 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.8 ptt180 -132.57 172.6 12.3 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.989 -179.779 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 48.91 58.0 5.82 Favored 'General case' 0 N--CA 1.463 0.204 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.655 HG21 ' CD1' ' A' ' 5' ' ' ILE . 8.4 p -79.32 131.64 36.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.979 178.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.753 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.8 pt20 -155.97 163.01 40.27 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.4 -179.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.751 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.42 135.79 38.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.546 179.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.86 144.34 47.43 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.272 179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.38 -151.71 31.34 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 119.799 -1.191 . . . . 0.0 111.3 -178.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.65 -37.06 18.38 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.839 0.681 . . . . 0.0 112.839 -178.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -140.54 35.44 1.83 Allowed 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.43 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.4 mp0 -115.15 146.89 40.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.059 0.457 . . . . 0.0 111.781 179.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.808 ' CB ' HD11 ' A' ' 37' ' ' LEU . 14.6 tp -122.04 124.25 43.52 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.014 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.81 144.07 46.54 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.935 0.398 . . . . 0.0 110.141 179.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.31 172.35 16.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.17 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -114.57 134.05 55.34 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 177.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.431 ' SG ' HD21 ' A' ' 98' ' ' LEU . 55.7 m -130.57 134.15 46.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.281 0.563 . . . . 0.0 111.894 -179.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.2 ptpt -66.04 137.48 57.12 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.423 -179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.635 HG22 ' O ' ' A' ' 95' ' ' ASP . 66.0 p -85.9 -176.43 5.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.644 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 77.5 mtt180 -62.93 -30.56 71.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.231 -179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.81 9.68 7.61 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -178.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 66.88 37.67 3.94 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 121.132 0.492 . . . . 0.0 111.425 -178.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.442 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 54.4 mt-30 -117.25 137.69 52.22 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.009 177.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -94.85 125.06 39.26 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.859 0.361 . . . . 0.0 111.849 -178.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 m -131.04 151.05 35.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.0 179.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.7 p -71.92 135.8 46.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.246 0.546 . . . . 0.0 111.876 -178.816 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.4 t -143.26 161.42 38.33 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.214 179.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.4 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 13.4 ttmt -142.2 156.1 45.31 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.411 0.624 . . . . 0.0 111.933 -179.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.422 HG23 ' O ' ' A' ' 35' ' ' ILE . 1.3 tp -138.42 125.0 26.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.115 -0.948 . . . . 0.0 108.818 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -86.8 119.13 26.7 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.677 0.275 . . . . 0.0 111.153 -178.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.856 HD22 HD22 ' A' ' 69' ' ' LEU . 4.4 mp -87.99 -16.0 34.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.634 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.444 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -57.69 -44.81 86.11 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.444 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.4 OUTLIER -91.76 -10.4 40.11 Favored 'General case' 0 N--CA 1.465 0.309 0 O-C-N 122.106 -0.371 . . . . 0.0 111.061 179.285 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.438 ' HB3' HD12 ' A' ' 41' ' ' ILE . 23.6 m-70 -97.87 -68.43 0.8 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.623 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.7 mp -78.59 150.67 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.287 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.439 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.09 172.58 12.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.953 -179.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.491 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 26.8 t30 -111.34 109.45 19.45 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.083 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 33.3 mm -109.88 89.69 1.33 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.407 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 55.6 t0 68.0 38.78 2.66 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.259 179.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.16 0.7 89.61 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.824 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.9 m -112.81 136.94 51.85 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.863 0.363 . . . . 0.0 110.882 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.415 HD22 HG21 ' A' ' 41' ' ' ILE . 13.5 mt -77.41 117.39 18.85 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.638 0.733 . . . . 0.0 111.281 -178.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 23.1 mttm -137.51 162.7 33.01 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.721 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.757 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.2 m-90 -87.27 121.89 30.32 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.087 0.47 . . . . 0.0 111.561 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.481 ' O ' ' N ' ' A' ' 53' ' ' SER . 3.2 tp60 -175.06 143.39 0.76 Allowed Pre-proline 0 C--N 1.33 -0.255 0 CA-C-N 115.639 -0.709 . . . . 0.0 109.873 -179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.402 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 23.4 Cg_endo -62.41 69.43 0.12 Allowed 'Trans proline' 0 C--N 1.35 0.607 0 C-N-CA 122.208 1.939 . . . . 0.0 112.553 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -160.49 134.75 7.29 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.834 179.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.431 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -82.49 108.42 15.88 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.158 0.504 . . . . 0.0 112.027 -178.068 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.44 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 33.4 p90 -47.63 -31.33 4.45 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.635 -0.712 . . . . 0.0 110.301 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 45.8 p -47.78 -16.25 0.07 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.316 -0.857 . . . . 0.0 113.006 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 67.1 mm-40 -64.56 -26.83 68.59 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.559 0.219 . . . . 0.0 111.381 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.491 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -134.01 5.41 3.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.322 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.6 m -115.18 148.98 38.38 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.228 0.537 . . . . 0.0 111.837 -178.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 21.0 p90 -142.84 157.63 44.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.968 -179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.4 m-20 63.34 46.07 4.63 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.981 0.42 . . . . 0.0 110.954 -179.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.751 ' O ' HD22 ' A' ' 13' ' ' LEU . 43.2 m -69.59 136.02 50.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.496 179.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.33 151.03 43.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.511 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.514 HG13 ' HB2' ' A' ' 13' ' ' LEU . 52.2 mt -129.81 140.89 47.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.225 0.536 . . . . 0.0 111.728 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -138.13 110.4 7.38 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.01 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.36 -122.28 14.77 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.269 -0.967 . . . . 0.0 111.101 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.436 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.3 p -101.32 -2.37 31.21 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.5 t -102.63 138.62 26.23 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.012 0.434 . . . . 0.0 112.109 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.856 HD22 HD22 ' A' ' 37' ' ' LEU . 8.7 tp -102.53 126.93 49.76 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.329 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.446 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -117.56 125.95 51.72 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 179.799 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.4 t -151.83 153.43 34.21 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.607 0.241 . . . . 0.0 111.16 -179.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 18.5 m -94.2 126.02 39.18 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 178.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 85.4 m -126.45 145.15 50.6 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -74.51 136.52 42.19 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.772 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.1 mtm180 -91.72 143.61 26.37 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 110.259 -0.274 . . . . 0.0 110.259 179.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 69.2 m -51.83 -27.23 11.82 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -83.67 2.28 38.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.65 0.262 . . . . 0.0 111.531 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.81 136.95 7.4 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.911 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.96 -169.73 13.07 Favored Glycine 0 N--CA 1.451 -0.325 0 N-CA-C 111.101 -0.8 . . . . 0.0 111.101 -178.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -130.8 142.04 50.38 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 117.304 0.552 . . . . 0.0 111.22 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 6.6 t-20 -154.15 129.13 9.53 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.517 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -92.75 134.33 35.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.271 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.3 p -122.77 158.18 30.76 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.377 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 57.8 p -121.01 144.88 48.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.906 0.384 . . . . 0.0 111.059 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.628 HD11 ' CH2' ' A' ' 50' ' ' TRP . 13.5 tt -144.21 143.0 23.82 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.168 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.399 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -96.88 115.86 28.17 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.995 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.605 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 16.1 mt -95.91 -7.19 37.38 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.952 ' ND2' HG22 ' A' ' 5' ' ' ILE . 13.9 t-20 -44.7 -27.83 0.54 Allowed 'General case' 0 N--CA 1.467 0.392 0 O-C-N 122.178 -0.326 . . . . 0.0 111.869 -178.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -81.88 -37.88 26.22 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.757 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -74.36 -53.87 16.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 113.415 0.894 . . . . 0.0 113.415 -178.181 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.552 HD12 ' HB3' ' A' ' 87' ' ' LEU . 3.0 mp -80.95 147.78 6.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.05 0.452 . . . . 0.0 111.465 -178.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.424 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 14.4 tt0 -138.07 164.45 29.08 Favored 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.91 -0.587 . . . . 0.0 109.852 -178.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 20.8 t30 -106.67 99.72 9.28 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.087 0.47 . . . . 0.0 110.528 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.453 ' HB ' ' CE ' ' A' ' 99' ' ' LYS . 39.1 t -99.86 96.65 5.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.187 179.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.635 ' O ' HG22 ' A' ' 25' ' ' THR . 19.2 t0 53.62 33.0 15.51 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 179.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 91.66 28.79 13.23 Favored Glycine 0 C--N 1.331 0.251 0 C-N-CA 120.697 -0.763 . . . . 0.0 113.054 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -141.91 134.33 28.05 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.746 0.308 . . . . 0.0 110.925 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.431 HD21 ' SG ' ' A' ' 23' ' ' CYS . 49.8 mt -75.06 119.14 18.82 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.12 0.486 . . . . 0.0 111.51 -179.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.453 ' CE ' ' HB ' ' A' ' 94' ' ' VAL . 0.9 OUTLIER -122.85 153.41 39.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.084 179.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 53.9 t80 -88.27 -61.25 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.928 -179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.834 -179.926 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.148 0 N-CA-C 112.487 -0.245 . . . . 0.0 112.487 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.21 -59.75 2.8 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.82 0.343 . . . . 0.0 110.914 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 164.35 149.4 5.77 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.464 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 8.1 mttt -154.9 85.37 1.1 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.732 0.301 . . . . 0.0 111.018 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.443 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 19.6 p90 -92.78 -40.8 10.47 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.543 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.929 HG22 ' ND2' ' A' ' 88' ' ' ASN . 7.8 tp -63.02 -19.84 24.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-O 120.673 0.273 . . . . 0.0 111.393 -179.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.506 ' OE2' HG23 ' A' ' 5' ' ' ILE . 38.2 mm-40 -78.48 -26.37 46.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.766 0.317 . . . . 0.0 110.726 179.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.6 p -118.32 13.83 13.71 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.984 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 63.9 m -129.77 156.2 44.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.933 0.397 . . . . 0.0 111.167 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.34 172.5 12.1 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.034 -179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 47.98 58.56 4.95 Favored 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.771 HG21 ' CD1' ' A' ' 5' ' ' ILE . 30.0 p -79.06 132.79 36.73 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 178.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.655 ' O ' HD12 ' A' ' 19' ' ' LEU . 3.7 pt20 -157.36 163.81 38.22 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.973 0.416 . . . . 0.0 111.453 -179.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.769 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.49 136.1 38.4 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.035 -179.835 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.444 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -118.6 143.45 46.79 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 179.029 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.04 -150.75 31.93 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 119.877 -1.154 . . . . 0.0 111.712 -179.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -87.21 -36.62 17.87 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -178.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.425 ' OG ' ' HB3' ' A' ' 38' ' ' ASP . 3.1 p -140.69 35.07 1.8 Allowed 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -178.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.444 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 3.0 mp0 -115.45 148.02 39.9 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.205 0.526 . . . . 0.0 112.123 179.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.816 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.8 tp -122.06 123.83 42.52 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.319 179.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.29 143.61 47.25 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.19 172.33 16.91 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.081 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -111.27 133.56 53.51 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 86.1 m -131.01 134.2 46.47 Favored 'General case' 0 C--N 1.328 -0.352 0 C-N-CA 120.416 -0.514 . . . . 0.0 112.277 -178.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 5.3 ptpt -67.11 137.42 56.33 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.489 -0.778 . . . . 0.0 111.728 -179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.59 HG22 ' O ' ' A' ' 95' ' ' ASP . 36.2 p -86.05 -178.96 6.67 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.602 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.0 mtt85 -61.41 -29.13 69.74 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.709 0.29 . . . . 0.0 111.222 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.16 10.41 8.35 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 66.51 36.33 5.07 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.138 0.494 . . . . 0.0 111.345 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.414 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 4.3 mt-30 -116.42 137.61 52.02 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.1 m-85 -93.92 125.3 38.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.945 0.402 . . . . 0.0 111.864 -178.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.4 m -131.0 150.74 34.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.696 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 m -72.53 135.96 45.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.145 0.498 . . . . 0.0 111.968 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.6 t -143.7 161.38 38.73 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.208 179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 32.0 ttpt -141.93 157.24 45.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.509 0.671 . . . . 0.0 112.283 -179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.535 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.3 tp -138.47 125.79 27.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.076 179.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -87.88 119.13 27.92 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.664 0.268 . . . . 0.0 110.998 -178.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.863 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -88.31 -14.54 38.05 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.5 p-10 -58.49 -43.46 89.02 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 112.213 0.449 . . . . 0.0 112.213 -178.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.455 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.9 OUTLIER -92.16 -10.94 36.97 Favored 'General case' 0 N--CA 1.465 0.306 0 O-C-N 122.096 -0.377 . . . . 0.0 111.8 179.568 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.451 ' CE1' ' CD2' ' A' ' 100' ' ' TYR . 38.9 m-70 -97.8 -59.77 1.7 Allowed 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.399 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.628 HD11 HD22 ' A' ' 87' ' ' LEU . 32.5 mm -81.28 146.16 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.575 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.494 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -139.02 170.34 16.16 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.298 -179.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.449 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 29.8 t30 -112.95 109.68 19.27 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.53 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.2 mm -110.02 89.6 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.069 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.4 t0 68.52 39.43 2.13 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.089 -179.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.28 5.57 89.5 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.598 -0.811 . . . . 0.0 112.864 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 6.7 m -115.23 136.42 53.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.793 0.33 . . . . 0.0 110.821 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.585 HD22 HG21 ' A' ' 41' ' ' ILE . 27.8 mt -77.53 116.15 17.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.666 0.746 . . . . 0.0 111.333 -178.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 mmtt -136.34 162.63 32.5 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.192 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.72 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 7.7 m-90 -86.07 123.47 31.41 Favored 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.587 -0.445 . . . . 0.0 111.323 -179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.494 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 2.8 mt-30 -172.03 152.6 2.95 Favored Pre-proline 0 N--CA 1.465 0.323 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.773 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 64.5 Cg_endo -73.06 63.26 4.14 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.023 1.815 . . . . 0.0 112.359 -179.572 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.408 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 4.4 p -155.92 135.03 12.11 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.506 179.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -81.22 109.56 15.87 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.182 0.515 . . . . 0.0 112.259 -177.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 30.8 p90 -47.3 -30.59 3.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.708 178.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 81.9 p -48.58 -18.12 0.22 Allowed 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -179.316 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -61.21 -28.07 68.89 Favored 'General case' 0 C--N 1.332 -0.17 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.933 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.449 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 6.1 p -130.7 1.34 4.43 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.3 m -111.47 149.18 31.68 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.192 0.52 . . . . 0.0 112.336 -178.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.6 p90 -141.55 156.56 45.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.817 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 74.8 m-20 63.98 47.22 3.49 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.884 0.373 . . . . 0.0 111.242 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.769 ' O ' HD22 ' A' ' 13' ' ' LEU . 73.4 m -69.92 134.89 48.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.453 179.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.72 152.14 43.57 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.599 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.459 HG13 ' HB2' ' A' ' 13' ' ' LEU . 39.5 mt -128.92 138.06 55.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 121.4 0.619 . . . . 0.0 112.034 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 25.8 mm-40 -133.77 106.46 7.35 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.005 -0.998 . . . . 0.0 109.079 179.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.31 -121.89 11.96 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.49 -0.862 . . . . 0.0 111.58 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.429 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 24.3 p -99.41 -4.4 31.61 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 -179.361 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.458 HG13 ' O ' ' A' ' 85' ' ' ILE . 3.5 t -102.04 140.51 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.214 0 CA-C-O 121.109 0.48 . . . . 0.0 112.191 -179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.863 HD22 HD22 ' A' ' 37' ' ' LEU . 9.3 tp -102.55 126.12 49.5 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.085 179.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.418 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.0 m -116.0 125.29 52.3 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 110.218 -0.289 . . . . 0.0 110.218 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.6 t -152.02 153.59 34.32 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.612 0.244 . . . . 0.0 111.353 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 22.1 m -95.05 126.44 40.39 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 178.504 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 76.6 m -126.02 145.06 50.47 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -74.5 136.58 42.21 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.848 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 1.8 mtt180 -93.2 144.37 25.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.691 0.282 . . . . 0.0 111.119 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 27.3 m -52.02 -28.83 18.49 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.635 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -82.61 1.7 36.94 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.638 0.256 . . . . 0.0 111.479 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.07 136.15 7.19 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.707 179.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.5 -170.91 13.47 Favored Glycine 0 C--N 1.319 -0.392 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 -178.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -129.54 143.12 50.69 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 117.286 0.543 . . . . 0.0 111.059 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -153.81 130.13 10.51 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.174 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.9 t -92.7 134.89 34.59 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.636 -179.236 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 26.4 p -122.21 157.79 30.83 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.197 179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 7.1 p -123.69 145.09 49.24 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.861 0.362 . . . . 0.0 111.086 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.72 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.3 tt -146.34 142.79 21.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.762 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -96.77 118.31 32.94 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.131 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.628 HD22 HD11 ' A' ' 41' ' ' ILE . 9.5 mt -97.4 -6.82 33.18 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.929 ' ND2' HG22 ' A' ' 5' ' ' ILE . 9.3 t-20 -45.06 -28.7 0.74 Allowed 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 112.087 0.403 . . . . 0.0 112.087 -178.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 67.9 m -80.59 -40.67 25.34 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.685 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.7 m -72.8 -50.82 30.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 N-CA-C 113.067 0.765 . . . . 0.0 113.067 -178.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.594 HD12 ' HB3' ' A' ' 87' ' ' LEU . 2.6 mp -82.93 147.35 5.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.137 0.494 . . . . 0.0 111.461 -178.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 4.9 tt0 -138.96 166.83 23.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.96 -178.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -108.02 99.91 9.3 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-O 121.059 0.457 . . . . 0.0 110.743 -179.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.43 HG21 ' HG3' ' A' ' 99' ' ' LYS . 48.2 t -99.17 96.88 5.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.848 179.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.59 ' O ' HG22 ' A' ' 25' ' ' THR . 30.0 t0 52.6 33.67 14.1 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.37 28.35 11.72 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.579 -0.82 . . . . 0.0 113.3 179.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.4 m -140.99 134.11 29.4 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.907 0.384 . . . . 0.0 111.2 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.414 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 59.3 mt -73.5 119.56 17.9 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.529 179.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.43 ' HG3' HG21 ' A' ' 94' ' ' VAL . 2.3 mmmt -125.18 141.75 51.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.194 0.521 . . . . 0.0 111.985 -179.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.451 ' CD2' ' CE1' ' A' ' 40' ' ' HIS . 46.1 t80 -78.36 -32.06 48.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.659 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.94 179.969 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.207 0 N-CA-C 112.52 -0.232 . . . . 0.0 112.52 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 52.1 tp -139.34 97.89 3.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.745 0.307 . . . . 0.0 110.986 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 61.65 -105.74 0.99 Allowed Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.804 -0.713 . . . . 0.0 112.532 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 51.7 mttt 62.99 70.01 0.56 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.928 0.394 . . . . 0.0 111.121 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.464 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 31.0 p90 -92.66 -38.97 11.56 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.127 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.96 HG22 ' ND2' ' A' ' 88' ' ' ASN . 6.8 tp -63.87 -17.63 20.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.736 0.303 . . . . 0.0 111.161 -179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -76.62 -26.47 54.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.959 179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.0 p -118.67 18.59 13.4 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.183 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.3 m -134.41 154.91 51.12 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.968 0.413 . . . . 0.0 111.063 -179.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.412 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 1.6 ptm180 -134.25 172.8 12.37 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.19 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.412 ' OD1' ' O ' ' A' ' 9' ' ' ARG . 6.3 p-10 49.04 57.4 6.5 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.0 -0.546 . . . . 0.0 112.3 179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.614 HG21 ' CD1' ' A' ' 5' ' ' ILE . 4.2 p -79.58 134.14 36.46 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 109.88 178.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.758 ' O ' HD12 ' A' ' 19' ' ' LEU . 3.1 pt20 -158.35 163.66 37.09 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.388 -179.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.761 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.31 135.85 38.64 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.156 0.503 . . . . 0.0 110.73 179.818 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.401 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.28 146.12 46.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.085 179.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.78 -153.33 25.31 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.814 -1.184 . . . . 0.0 111.408 -179.021 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.0 -36.85 19.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -141.04 36.23 1.74 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.401 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.9 OUTLIER -116.05 146.09 42.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.168 0.509 . . . . 0.0 111.881 179.172 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.758 HD12 ' O ' ' A' ' 12' ' ' GLN . 15.2 tp -120.89 125.07 46.54 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.565 -0.743 . . . . 0.0 109.175 178.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.6 143.93 47.39 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.858 0.361 . . . . 0.0 110.031 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.28 172.51 16.51 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.386 -178.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.15 133.54 54.23 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 177.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.2 m -130.77 132.82 45.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.158 0.504 . . . . 0.0 112.043 -178.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.425 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.1 ptpt -66.52 135.73 54.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.105 -179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.0 p -85.89 -176.28 5.93 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.633 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.1 mtt-85 -61.46 -29.91 70.25 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.742 0.306 . . . . 0.0 111.257 -179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.76 8.86 9.0 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 66.53 37.06 4.69 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.169 0.509 . . . . 0.0 111.059 -178.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.425 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 1.0 OUTLIER -118.24 136.33 53.73 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.995 178.103 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -92.64 125.47 37.28 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.921 0.391 . . . . 0.0 111.858 -178.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.1 m -129.87 152.56 37.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.828 179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 47.4 t -72.75 133.54 44.59 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.178 0.513 . . . . 0.0 111.592 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -142.11 161.37 38.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.272 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.5 ttmt -142.5 154.99 45.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.407 0.622 . . . . 0.0 112.206 -178.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.573 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -136.41 124.87 36.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.821 179.18 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -88.64 120.29 29.9 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.683 0.278 . . . . 0.0 111.036 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.849 HD22 HD22 ' A' ' 69' ' ' LEU . 4.5 mp -88.05 -14.52 38.73 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.5 p-10 -57.49 -45.06 85.34 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -178.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.8 OUTLIER -92.3 -10.53 38.03 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 122.106 -0.371 . . . . 0.0 111.569 179.434 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -98.12 -65.56 0.96 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.604 HG13 HD23 ' A' ' 37' ' ' LEU . 15.7 mm -80.48 150.16 4.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.708 178.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.504 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.18 172.29 12.89 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.726 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.474 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 24.9 t30 -112.71 110.57 20.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.373 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 45.8 mm -110.86 89.62 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.042 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.4 t70 68.71 39.19 2.04 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.908 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.75 0.66 90.29 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.978 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 11.1 m -110.53 136.74 49.19 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.933 0.397 . . . . 0.0 110.858 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.9 mt -77.08 116.31 17.62 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.544 0.687 . . . . 0.0 111.012 -178.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 31.4 mttt -135.25 161.92 34.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.015 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.732 ' CE2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -86.58 119.15 26.52 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.938 0.399 . . . . 0.0 111.19 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.504 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 1.3 tp-100 -175.51 141.56 0.64 Allowed Pre-proline 0 C--N 1.331 -0.208 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.201 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -61.47 76.17 0.09 OUTLIER 'Trans proline' 0 C--N 1.349 0.576 0 C-N-CA 122.265 1.977 . . . . 0.0 112.781 -179.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -166.89 135.41 2.73 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.665 179.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.08 108.99 15.99 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.416 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 25.4 p90 -49.51 -31.0 9.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.761 178.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 54.1 p -48.9 -16.77 0.14 Allowed 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 112.956 0.724 . . . . 0.0 112.956 -179.122 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -63.27 -29.53 70.84 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.15 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.474 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -128.89 1.86 5.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.642 -0.254 . . . . 0.0 111.286 179.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.405 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.7 m -112.79 147.93 35.87 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.244 0.545 . . . . 0.0 111.864 -178.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 26.6 p90 -143.21 157.74 44.23 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.929 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 75.0 m-20 63.32 44.24 5.66 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.006 0.432 . . . . 0.0 110.485 -179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.761 ' O ' HD22 ' A' ' 13' ' ' LEU . 20.5 m -69.08 137.14 53.26 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.466 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.405 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.87 152.89 42.61 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.596 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.488 ' CD1' HD13 ' A' ' 19' ' ' LEU . 33.8 mt -129.72 140.44 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.403 0 CA-C-O 121.288 0.566 . . . . 0.0 111.805 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -136.19 108.55 7.33 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.193 -0.912 . . . . 0.0 108.791 178.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.411 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.93 -120.84 12.97 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 120.431 -0.89 . . . . 0.0 111.243 -178.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.402 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.9 p -101.72 -3.67 27.78 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -179.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.537 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.1 t -101.88 139.23 23.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 120.977 0.418 . . . . 0.0 111.756 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.849 HD22 HD22 ' A' ' 37' ' ' LEU . 10.6 tp -100.93 125.12 47.48 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.332 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 3.6 m -115.6 123.49 48.56 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.2 t -151.92 153.83 34.91 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.41 -178.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 6.3 m -94.18 125.78 39.02 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 88.0 m -126.01 143.95 50.9 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -178.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -74.13 136.84 42.93 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.753 178.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.414 ' NH1' ' HB3' ' A' ' 75' ' ' ARG . 12.5 mtp-105 -92.15 144.21 25.65 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.724 0.297 . . . . 0.0 110.503 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 42.2 m -52.06 -27.12 12.72 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.749 -179.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -83.56 2.39 37.37 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.617 0.246 . . . . 0.0 111.651 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.73 136.26 7.07 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.687 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.62 -169.6 12.99 Favored Glycine 0 C--N 1.318 -0.434 0 N-CA-C 111.29 -0.724 . . . . 0.0 111.29 -178.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -130.0 142.05 50.67 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 117.266 0.533 . . . . 0.0 111.123 -179.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -153.79 128.74 9.55 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.203 -179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.7 t -93.12 134.69 35.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.607 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.3 p -122.9 158.35 30.56 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.443 179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 14.9 m -122.71 145.64 48.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.902 0.382 . . . . 0.0 111.201 -179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.717 HD11 ' CH2' ' A' ' 50' ' ' TRP . 9.9 tt -145.33 143.72 21.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.812 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -97.1 116.29 29.04 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.745 179.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.548 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 11.2 mt -97.62 -4.54 37.32 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.96 ' ND2' HG22 ' A' ' 5' ' ' ILE . 12.4 t-20 -44.92 -27.72 0.57 Allowed 'General case' 0 N--CA 1.466 0.342 0 O-C-N 122.155 -0.341 . . . . 0.0 111.874 -178.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -81.5 -41.28 21.95 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -179.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.732 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.5 m -72.67 -52.33 23.63 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 -178.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.653 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -83.13 147.37 5.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.103 0.477 . . . . 0.0 111.279 -179.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.482 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 16.9 tt0 -139.92 167.09 22.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.14 -178.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -107.37 99.9 9.38 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 121.101 0.477 . . . . 0.0 110.805 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 58.8 t -98.53 97.48 6.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.007 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.7 t0 53.07 33.74 15.65 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.27 28.31 11.9 Favored Glycine 0 C--N 1.331 0.262 0 C-N-CA 120.662 -0.78 . . . . 0.0 113.111 179.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.7 m -141.58 135.7 30.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.871 0.367 . . . . 0.0 111.279 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.482 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 63.0 mt -74.24 120.48 19.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.801 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.445 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 14.7 mttt -123.87 137.46 54.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.36 -179.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.429 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 34.9 t80 -82.25 -28.38 31.9 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.791 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.287 -0.864 . . . . 0.0 110.903 179.871 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . 0.406 ' O ' ' N ' ' A' ' 2' ' ' GLY . . . . . . . . 0 N--CA 1.489 2.204 0 N-CA-C 112.597 -0.201 . . . . 0.0 112.597 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 48.5 mt 62.56 -78.37 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.184 0 CA-C-O 120.821 0.343 . . . . 0.0 110.934 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.406 ' N ' ' O ' ' A' ' -1' ' ' GLY . . . -141.06 -86.28 0.1 Allowed Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.82 -0.705 . . . . 0.0 112.408 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 29.1 mttt 63.3 71.15 0.51 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.96 0.41 . . . . 0.0 110.748 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.2 p90 -92.15 -37.0 12.99 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.348 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.949 HG22 ' ND2' ' A' ' 88' ' ' ASN . 5.8 tp -67.7 -11.74 14.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 C-N-CA 120.85 -0.34 . . . . 0.0 111.365 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -76.74 -26.08 54.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.834 0.35 . . . . 0.0 110.552 179.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 44.0 p -118.37 -3.35 10.97 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.447 179.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 70.6 m -108.11 150.6 26.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.126 0.488 . . . . 0.0 111.402 -179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.401 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.4 ptm180 -131.87 172.47 12.27 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.506 179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.406 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.8 p-10 49.45 56.97 7.02 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.062 0.458 . . . . 0.0 111.685 -179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.707 HG21 ' CD1' ' A' ' 5' ' ' ILE . 8.3 p -79.32 132.59 36.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.691 178.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.726 ' O ' HD12 ' A' ' 19' ' ' LEU . 2.6 pt20 -158.14 163.89 37.14 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.44 -179.229 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.72 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.31 136.38 37.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.028 -179.624 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.81 143.59 47.78 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.163 179.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.07 -152.27 33.03 Favored Glycine 0 N--CA 1.449 -0.437 0 C-N-CA 119.78 -1.2 . . . . 0.0 111.324 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.23 -36.74 19.23 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.863 0.69 . . . . 0.0 112.863 -178.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.439 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.1 p -140.9 34.96 1.76 Allowed 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 112.758 0.651 . . . . 0.0 112.758 -178.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -115.22 148.8 38.66 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.073 0.463 . . . . 0.0 111.662 178.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.766 ' CB ' HD11 ' A' ' 37' ' ' LEU . 12.6 tp -122.97 124.9 44.22 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.346 179.231 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.06 144.15 46.73 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 179.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.3 172.48 16.53 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.117 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -116.51 133.38 56.09 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 177.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.416 ' SG ' HD21 ' A' ' 98' ' ' LEU . 17.2 m -130.73 136.77 49.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.027 0.441 . . . . 0.0 111.893 -178.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.3 ptpt -66.74 137.9 56.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.481 -179.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.465 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.2 p -86.44 -175.78 5.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.879 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 -61.64 -31.41 71.51 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.676 0.274 . . . . 0.0 111.523 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.63 9.61 9.14 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 66.84 39.7 3.35 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.274 0.559 . . . . 0.0 111.381 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.43 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 74.8 mt-30 -118.82 136.65 53.89 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.28 -0.873 . . . . 0.0 108.664 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 66.0 m-85 -93.77 124.82 38.02 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.898 0.38 . . . . 0.0 111.641 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.7 m -131.5 148.92 32.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.584 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 73.3 m -71.5 138.57 49.05 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.328 0.585 . . . . 0.0 112.044 -178.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.6 t -143.94 161.25 39.19 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.18 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmmm? -139.87 154.61 47.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.396 0.617 . . . . 0.0 112.42 -179.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.446 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.3 tp -137.78 125.08 29.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 115.048 -0.978 . . . . 0.0 108.925 179.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -88.97 120.61 30.55 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.728 0.299 . . . . 0.0 111.071 -178.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.97 HD22 HD22 ' A' ' 69' ' ' LEU . 4.6 mp -88.98 -15.75 33.41 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.982 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.3 p-10 -57.82 -43.06 85.48 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 111.908 0.336 . . . . 0.0 111.908 -178.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.424 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 7.9 p-10 -92.77 -11.34 34.06 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 122.135 -0.353 . . . . 0.0 111.493 179.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.436 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 22.9 m-70 -97.61 -65.95 0.93 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.616 HD12 ' N ' ' A' ' 41' ' ' ILE . 2.1 mp -80.77 148.78 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.172 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.3 170.84 14.96 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.116 -179.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.538 ' C ' HD12 ' A' ' 44' ' ' ILE . 19.4 t30 -113.03 113.23 25.17 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.926 -179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.743 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.4 mp -113.16 89.44 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.028 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.6 t70 69.62 36.83 2.05 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.006 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.81 1.31 85.25 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.695 -0.764 . . . . 0.0 113.467 179.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 18.1 m -111.69 135.81 51.78 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 117.252 0.526 . . . . 0.0 111.255 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.3 mt -77.59 116.92 18.54 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.648 0.737 . . . . 0.0 111.599 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.743 ' HB2' HD13 ' A' ' 44' ' ' ILE . 9.8 mttm -137.82 162.74 33.16 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.672 -1.149 . . . . 0.0 109.921 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.881 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 11.6 m-90 -87.02 121.8 29.98 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.882 0.372 . . . . 0.0 111.184 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.42 ' O ' ' N ' ' A' ' 53' ' ' SER . 35.2 tt0 -175.6 144.75 0.77 Allowed Pre-proline 0 N--CA 1.464 0.231 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.984 -179.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.424 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 29.9 Cg_endo -64.45 71.56 0.21 Allowed 'Trans proline' 0 C--N 1.35 0.608 0 C-N-CA 122.084 1.856 . . . . 0.0 112.785 -179.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.42 ' N ' ' O ' ' A' ' 51' ' ' GLN . 4.0 p -162.86 133.31 4.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.527 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -81.07 110.18 16.35 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -177.869 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.424 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 37.8 p90 -48.83 -29.38 4.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.402 178.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 74.8 p -48.65 -19.08 0.31 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.843 -179.361 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.8 mm100 -61.58 -30.49 70.71 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 121.012 -0.275 . . . . 0.0 111.34 -178.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.426 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -127.96 -0.19 5.94 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.146 -0.222 . . . . 0.0 111.496 179.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -110.95 149.19 31.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.247 0.546 . . . . 0.0 112.292 -178.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 4.9 p90 -143.02 157.43 44.55 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.102 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 68.9 m-20 64.03 46.52 3.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.003 0.43 . . . . 0.0 110.536 -179.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.72 ' O ' HD22 ' A' ' 13' ' ' LEU . 26.9 m -69.51 136.7 51.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.71 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.451 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.27 151.56 42.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.686 -179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.53 HG21 HD13 ' A' ' 19' ' ' LEU . 37.5 mt -130.6 139.04 52.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.354 0.597 . . . . 0.0 111.738 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 69.5 mt-30 -136.44 111.08 8.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.21 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.49 -121.26 17.14 Favored Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.161 -1.019 . . . . 0.0 110.934 -178.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.452 ' HB3' HG21 ' A' ' 5' ' ' ILE . 23.0 p -101.07 -3.88 28.44 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.242 0.46 . . . . 0.0 112.242 -179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.515 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.7 t -101.67 138.43 25.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.97 HD22 HD22 ' A' ' 37' ' ' LEU . 7.9 tp -102.56 123.78 46.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.127 179.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.426 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.3 m -114.48 125.86 54.3 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 110.205 -0.295 . . . . 0.0 110.205 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.6 t -151.57 153.83 35.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.774 0.321 . . . . 0.0 111.494 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 8.5 m -93.91 126.18 38.96 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 178.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 82.7 m -126.03 142.74 51.39 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 -178.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -75.58 140.1 42.48 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.799 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 3.0 mtt-85 -92.82 143.51 26.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.686 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 37.3 m -51.94 -29.78 21.78 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.753 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -82.47 3.02 29.97 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.578 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.79 134.68 6.9 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.793 179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 118.27 -174.77 15.43 Favored Glycine 0 C--N 1.318 -0.448 0 N-CA-C 111.33 -0.708 . . . . 0.0 111.33 -178.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -129.34 141.74 51.0 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 117.356 0.578 . . . . 0.0 110.845 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -153.95 130.31 10.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.424 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.1 t -92.51 134.49 34.92 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.48 -179.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 23.8 p -121.42 157.88 29.56 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.901 179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -123.14 146.2 47.95 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.866 0.365 . . . . 0.0 111.301 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.881 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.7 tt -146.43 143.3 20.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.869 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -95.98 117.02 29.82 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.848 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.686 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 10.1 mt -96.1 -5.19 41.39 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -178.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.949 ' ND2' HG22 ' A' ' 5' ' ' ILE . 10.3 t-20 -44.73 -27.63 0.52 Allowed 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -178.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 44.1 m -81.1 -39.67 25.31 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -179.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.74 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -73.49 -53.43 18.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -177.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.606 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.89 147.13 6.14 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-O 121.175 0.512 . . . . 0.0 112.042 -178.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.45 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 12.5 tt0 -138.96 166.17 25.18 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.923 -179.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -107.58 99.75 9.22 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.193 0.52 . . . . 0.0 110.767 -179.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.481 HG11 ' HE3' ' A' ' 99' ' ' LYS . 40.6 t -97.93 96.98 5.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.745 179.136 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.465 ' O ' HG22 ' A' ' 25' ' ' THR . 22.3 t0 54.07 33.11 16.98 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.704 0.288 . . . . 0.0 111.56 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.56 28.45 12.67 Favored Glycine 0 CA--C 1.519 0.288 0 C-N-CA 120.723 -0.751 . . . . 0.0 113.223 179.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 68.0 p -140.33 135.94 32.7 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.898 0.38 . . . . 0.0 111.219 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.45 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 31.2 mt -74.21 119.35 18.3 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.067 -179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.481 ' HE3' HG11 ' A' ' 94' ' ' VAL . 7.1 mttt -124.29 138.25 54.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.447 -179.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.436 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 32.5 t80 -79.23 150.21 31.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.01 179.575 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.405 ' N ' ' O ' ' A' ' 90' ' ' VAL . 11.7 tt0 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.191 -0.909 . . . . 0.0 111.081 -179.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 112.537 -0.225 . . . . 0.0 112.537 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 10.1 tp -96.45 159.08 15.13 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.863 0.363 . . . . 0.0 110.978 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -65.32 -85.7 0.07 OUTLIER Glycine 0 CA--C 1.518 0.265 0 C-N-CA 120.911 -0.662 . . . . 0.0 112.744 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.3 mttt 65.58 72.73 0.41 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.763 0.316 . . . . 0.0 110.909 -179.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.437 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 19.7 p90 -95.8 -38.0 10.5 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.444 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.949 HG22 ' ND2' ' A' ' 88' ' ' ASN . 3.8 tp -65.5 -14.43 16.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.707 0.289 . . . . 0.0 111.129 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 13.5 mp0 -76.33 -27.23 56.43 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.786 0.327 . . . . 0.0 110.528 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.3 p -119.23 19.1 12.92 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.181 178.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 72.9 m -131.35 154.86 48.14 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.136 0.494 . . . . 0.0 111.771 -179.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -134.93 173.07 12.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.571 -0.741 . . . . 0.0 111.065 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.6 p30 49.32 57.12 6.83 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.706 HG21 ' CD1' ' A' ' 5' ' ' ILE . 4.9 p -79.54 130.55 35.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.63 178.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.634 ' O ' HD12 ' A' ' 19' ' ' LEU . 3.4 pt20 -156.43 163.26 39.66 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.64 -179.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.682 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.98 136.6 38.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.187 -179.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.88 143.17 48.08 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.462 179.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.3 -150.1 37.93 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.025 -1.083 . . . . 0.0 111.82 -179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.69 -37.1 18.28 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -178.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -143.23 35.64 1.35 Allowed 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -178.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -114.43 146.57 40.45 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.815 0.34 . . . . 0.0 111.484 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.775 ' HB3' HD11 ' A' ' 37' ' ' LEU . 9.9 tp -120.29 123.21 42.6 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.285 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.18 144.63 47.6 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.56 172.55 16.17 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.876 -178.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 85.7 mt-10 -112.3 134.31 53.91 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 177.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 80.0 m -130.46 134.83 47.4 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 120.39 -0.524 . . . . 0.0 112.228 -178.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 6.3 ptpt -67.3 135.51 53.44 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.326 -179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.585 HG22 ' O ' ' A' ' 95' ' ' ASP . 64.1 p -85.16 -179.33 6.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.27 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 45.8 mtt-85 -59.3 -29.69 67.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.559 -179.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.79 10.68 8.94 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 66.9 39.27 3.39 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.025 0.441 . . . . 0.0 112.005 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 19.0 mm100 -121.44 132.63 54.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 178.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.445 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 46.8 m-85 -90.65 126.46 35.98 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.108 0.48 . . . . 0.0 111.922 -178.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.1 m -131.06 151.61 36.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.793 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 41.5 m -71.06 134.6 47.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.228 0.537 . . . . 0.0 111.948 -178.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.3 t -142.11 161.82 37.04 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.284 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.11 156.02 45.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.321 0.582 . . . . 0.0 112.394 -179.018 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.455 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -138.46 125.0 25.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 115.113 -0.949 . . . . 0.0 108.774 179.25 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -87.17 115.92 24.9 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.649 0.261 . . . . 0.0 111.199 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.865 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -87.17 -16.29 35.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.561 -0.29 . . . . 0.0 111.391 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.86 -45.84 74.62 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.64 0.257 . . . . 0.0 111.467 -178.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -92.47 -10.4 37.96 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.401 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 28.6 m-70 -97.86 -65.9 0.93 Allowed 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.62 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.9 mp -80.03 149.29 5.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.295 178.755 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.408 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.36 172.68 12.35 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.933 -179.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.529 ' C ' HD12 ' A' ' 44' ' ' ILE . 20.0 t30 -112.72 112.27 23.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.219 -179.03 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.808 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.1 mp -111.85 93.46 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-O 120.865 0.364 . . . . 0.0 110.805 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 38.3 t0 64.78 39.64 6.07 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.206 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.28 1.83 90.38 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.562 -0.828 . . . . 0.0 113.123 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 20.9 m -112.46 137.13 51.11 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 117.187 0.494 . . . . 0.0 111.004 179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 66.3 mt -77.72 118.55 20.2 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.433 0.635 . . . . 0.0 112.326 -177.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.808 ' HB2' HD13 ' A' ' 44' ' ' ILE . 37.5 mttt -139.65 163.34 32.84 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.101 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.743 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.8 m-90 -87.1 121.71 29.94 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 111.637 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.447 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 38.5 tt0 -175.26 145.3 0.85 Allowed Pre-proline 0 N--CA 1.466 0.332 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.909 -179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.447 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 37.1 Cg_endo -65.25 71.26 0.28 Allowed 'Trans proline' 0 C--N 1.35 0.656 0 C-N-CA 122.267 1.978 . . . . 0.0 112.797 -179.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.405 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.1 p -162.48 133.19 4.84 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 114.88 -1.055 . . . . 0.0 108.47 179.064 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.16 112.4 18.47 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 121.247 0.546 . . . . 0.0 112.457 -177.634 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.473 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 49.3 p90 -51.56 -30.39 20.56 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.952 178.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.7 p -50.87 -17.36 0.55 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -62.07 -29.46 70.32 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.042 -0.263 . . . . 0.0 110.634 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.438 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -129.04 0.66 5.25 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 116.554 -0.294 . . . . 0.0 111.664 179.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.5 m -112.16 147.96 35.02 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.112 0.482 . . . . 0.0 112.06 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 31.1 p90 -141.71 157.39 45.11 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.24 -179.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.8 m-20 63.49 44.89 5.05 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.105 0.479 . . . . 0.0 110.456 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.682 ' O ' HD22 ' A' ' 13' ' ' LEU . 70.7 m -68.51 137.0 54.04 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.663 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.62 152.6 41.57 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.822 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.471 ' CG1' HD13 ' A' ' 69' ' ' LEU . 58.3 mt -130.94 140.74 47.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.337 0.589 . . . . 0.0 111.628 179.513 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -137.78 109.48 7.07 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.652 179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.89 -122.43 13.49 Favored Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.41 -0.9 . . . . 0.0 111.675 -178.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.492 ' HB3' HG21 ' A' ' 5' ' ' ILE . 22.4 p -101.78 -2.8 29.28 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 117.012 0.406 . . . . 0.0 112.085 -179.427 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.43 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.5 t -102.54 137.3 31.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 CA-C-O 120.957 0.408 . . . . 0.0 111.752 179.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.865 HD22 HD22 ' A' ' 37' ' ' LEU . 7.5 tp -100.89 124.08 46.04 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.349 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.448 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -114.24 125.5 53.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.111 -179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.7 t -151.58 153.59 34.81 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.794 0.331 . . . . 0.0 111.722 -179.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.1 m -94.42 126.02 39.43 Favored 'General case' 0 N--CA 1.457 -0.125 0 N-CA-C 109.746 -0.464 . . . . 0.0 109.746 178.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.3 m -127.7 145.32 50.94 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -178.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -74.86 138.03 42.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.477 177.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 56.4 mtp180 -91.09 142.98 27.17 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.555 0.217 . . . . 0.0 110.532 179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 62.7 m -52.1 -25.13 8.06 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 120.694 0.283 . . . . 0.0 111.554 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -84.13 1.57 43.63 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.387 179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.42 135.83 7.21 Favored Glycine 0 C--N 1.332 0.352 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.839 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.06 -167.34 12.3 Favored Glycine 0 C--N 1.32 -0.335 0 N-CA-C 111.258 -0.737 . . . . 0.0 111.258 -178.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -131.99 141.49 49.29 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 117.329 0.564 . . . . 0.0 111.594 -179.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -153.99 129.89 10.19 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.454 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.525 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.6 t -92.13 135.18 34.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.737 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 70.2 p -121.88 158.33 29.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.203 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 4.5 p -121.87 145.65 47.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.797 0.332 . . . . 0.0 111.104 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.712 HD11 ' CH2' ' A' ' 50' ' ' TRP . 13.2 tt -144.42 143.32 23.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.647 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -97.15 117.6 31.7 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.781 179.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.625 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 6.8 mt -99.4 -4.61 31.16 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -178.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.949 ' ND2' HG22 ' A' ' 5' ' ' ILE . 10.7 t-20 -44.82 -29.1 0.73 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -178.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.7 m -81.32 -41.67 21.73 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.743 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -70.58 -52.76 26.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 -177.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.581 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.8 mp -83.33 147.59 5.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.913 0.387 . . . . 0.0 111.543 -179.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.419 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 31.3 tt0 -138.51 165.57 26.52 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.22 -179.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -105.96 99.53 9.11 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 121.183 0.516 . . . . 0.0 110.766 -179.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 47.8 t -97.54 97.12 5.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.538 178.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.585 ' O ' HG22 ' A' ' 25' ' ' THR . 26.0 t0 53.19 33.29 14.95 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.763 0.282 . . . . 0.0 111.763 179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.5 28.63 11.13 Favored Glycine 0 C--N 1.332 0.321 0 C-N-CA 120.752 -0.737 . . . . 0.0 113.253 179.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -141.28 135.24 30.42 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.931 0.396 . . . . 0.0 110.971 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 79.2 mt -74.01 119.86 18.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.803 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.6 mttm -123.02 131.03 53.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.417 -179.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.423 ' CE2' ' HB ' ' A' ' 90' ' ' VAL . 14.2 t80 -84.06 -45.8 12.66 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.147 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.289 -0.862 . . . . 0.0 111.103 -179.986 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.203 0 N-CA-C 112.493 -0.243 . . . . 0.0 112.493 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -158.43 128.37 5.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.669 0.271 . . . . 0.0 110.838 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 154.73 148.58 5.02 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.617 -0.802 . . . . 0.0 112.736 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.3 ptpt -152.15 86.22 1.29 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.766 0.317 . . . . 0.0 111.171 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.425 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 13.6 p90 -93.11 -40.61 10.41 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.296 179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.886 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.0 tp -63.04 -20.04 24.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.449 -179.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -77.64 -25.51 49.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.784 0.326 . . . . 0.0 110.552 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 73.0 p -118.4 16.66 13.87 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.849 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.3 m -134.13 155.7 49.61 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.99 0.424 . . . . 0.0 111.37 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.41 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.9 ptt180 -132.29 172.9 11.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.945 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.438 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.2 p-10 49.52 57.46 6.48 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 116.102 -0.499 . . . . 0.0 112.239 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.614 HG21 ' CD1' ' A' ' 5' ' ' ILE . 19.3 p -78.94 132.15 36.62 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.659 ' O ' HD12 ' A' ' 19' ' ' LEU . 8.3 pt20 -157.66 163.85 37.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.616 -179.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.676 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.21 136.52 37.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.037 -179.626 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.9 143.63 47.85 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.134 179.039 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.15 -152.19 33.51 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 119.849 -1.167 . . . . 0.0 111.534 -178.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.47 -37.01 18.71 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -178.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.1 p -141.25 35.65 1.7 Allowed 'General case' 0 CA--C 1.531 0.228 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.403 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.0 OUTLIER -115.69 146.74 41.59 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.156 0.503 . . . . 0.0 111.833 178.873 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.823 ' CB ' HD11 ' A' ' 37' ' ' LEU . 13.3 tp -119.09 124.13 46.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.54 -0.755 . . . . 0.0 109.321 179.023 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.85 143.19 47.12 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.09 172.24 17.15 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.33 -178.645 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -112.17 133.65 54.18 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 177.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 83.7 m -130.97 134.56 46.84 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 -178.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.419 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.2 ptpt -67.03 136.02 54.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.241 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.498 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.8 p -85.77 -177.81 6.46 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.272 179.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.8 mmp_? -61.26 -29.32 69.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.87 0.366 . . . . 0.0 110.794 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.44 8.72 8.71 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.748 0.647 . . . . 0.0 112.748 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 66.56 36.35 4.98 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.262 0.553 . . . . 0.0 111.037 -178.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.419 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 25.2 mt-30 -118.53 136.93 53.55 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.862 178.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -93.06 124.76 37.26 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.909 0.385 . . . . 0.0 111.702 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.44 HG22 HG23 ' A' ' 25' ' ' THR . 4.2 m -129.98 149.72 33.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.619 179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 25.2 p -71.02 135.06 47.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.185 0.517 . . . . 0.0 111.88 -178.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.9 t -142.51 161.42 38.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.253 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 24.0 ttpp -142.35 156.72 45.26 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.394 0.616 . . . . 0.0 112.371 -178.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.582 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -139.52 125.18 21.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.087 179.335 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -87.66 120.35 28.89 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.663 0.268 . . . . 0.0 111.289 -178.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.823 HD11 ' CB ' ' A' ' 19' ' ' LEU . 4.2 mp -88.35 -15.29 36.02 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.825 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.428 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.6 p-10 -57.51 -43.36 84.19 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 5.1 p30 -92.48 -10.58 37.31 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 122.077 -0.389 . . . . 0.0 111.848 179.307 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -99.51 -63.33 1.13 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 179.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.62 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.5 mp -79.64 147.16 6.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.791 178.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.42 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.41 170.05 16.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.654 -178.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.53 ' C ' HD12 ' A' ' 44' ' ' ILE . 27.1 t30 -113.21 111.79 22.66 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.292 -179.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.792 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.3 mp -112.37 89.56 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.529 179.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.3 t70 68.52 38.81 2.27 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.042 -179.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.95 0.83 90.52 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.624 -0.798 . . . . 0.0 113.426 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.8 m -108.72 135.33 50.12 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 117.334 0.567 . . . . 0.0 110.507 179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.456 HD22 HG21 ' A' ' 41' ' ' ILE . 20.0 mt -77.49 117.0 18.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.65 0.738 . . . . 0.0 111.693 -177.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.792 ' HB2' HD13 ' A' ' 44' ' ' ILE . 10.3 mttm -138.3 163.26 32.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.6 -1.182 . . . . 0.0 109.577 179.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.702 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.1 m-90 -88.03 122.4 31.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.856 0.36 . . . . 0.0 111.791 -179.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.455 ' CG ' ' O ' ' A' ' 50' ' ' TRP . 26.4 mt-30 -171.16 149.81 2.73 Favored Pre-proline 0 N--CA 1.47 0.53 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.65 179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -69.74 66.48 1.76 Allowed 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 121.831 1.687 . . . . 0.0 112.035 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.7 134.57 9.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 114.967 -1.015 . . . . 0.0 108.732 179.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -81.54 109.88 16.41 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -178.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.437 ' CD1' HG22 ' A' ' 41' ' ' ILE . 38.4 p90 -48.45 -29.73 4.39 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.576 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 67.2 p -48.36 -19.36 0.3 Allowed 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -179.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -62.46 -24.82 67.65 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.499 -178.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.446 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.9 p -133.3 2.4 3.55 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.779 0.288 . . . . 0.0 111.779 179.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.4 m -112.58 148.53 34.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.13 0.49 . . . . 0.0 112.318 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -139.97 155.51 47.09 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.942 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 64.19 49.63 2.59 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.953 0.406 . . . . 0.0 111.103 -179.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.676 ' O ' HD22 ' A' ' 13' ' ' LEU . 44.9 m -71.34 135.2 47.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.788 179.718 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.505 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.85 151.93 41.61 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.507 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.462 ' CG1' HD13 ' A' ' 69' ' ' LEU . 38.1 mt -129.94 140.49 48.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 121.27 0.557 . . . . 0.0 111.848 -179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 28.4 mt-30 -136.6 110.63 8.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.507 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.32 -121.87 16.71 Favored Glycine 0 N--CA 1.447 -0.589 0 C-N-CA 120.224 -0.989 . . . . 0.0 110.887 -178.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.424 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.6 p -101.54 -3.21 28.9 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.581 HG13 ' O ' ' A' ' 85' ' ' ILE . 9.0 t -102.86 140.7 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.216 0 CA-C-O 120.985 0.421 . . . . 0.0 111.814 179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.807 HD22 HD22 ' A' ' 37' ' ' LEU . 9.2 tp -102.85 126.79 50.13 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.498 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.418 ' N ' HD12 ' A' ' 69' ' ' LEU . 5.6 m -115.21 124.23 50.87 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.9 t -151.78 153.64 34.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.742 0.306 . . . . 0.0 111.288 -178.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.8 m -94.42 125.7 39.23 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 178.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 75.2 m -126.16 143.41 51.14 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.435 0.636 . . . . 0.0 112.514 -178.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -75.7 139.53 41.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.89 178.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 47.8 mtp85 -93.55 144.63 25.19 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.754 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.6 m -51.85 -28.39 15.76 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.786 -179.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -83.15 1.98 37.74 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.497 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.2 136.69 7.48 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.778 179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.7 -170.78 13.51 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 111.193 -0.763 . . . . 0.0 111.193 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -131.22 141.85 50.09 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 117.238 0.519 . . . . 0.0 111.121 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 41.0 t30 -154.14 129.49 9.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.347 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.2 t -92.72 134.78 34.7 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.714 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.4 p -121.83 158.48 28.82 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.546 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 46.0 m -121.9 143.96 49.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.359 -179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.699 HD11 ' CH2' ' A' ' 50' ' ' TRP . 12.6 tt -145.11 143.08 22.51 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.843 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -96.97 116.26 28.88 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.035 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.61 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 9.8 mt -97.44 -6.83 33.04 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -179.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.886 ' ND2' HG22 ' A' ' 5' ' ' ILE . 7.4 t-20 -45.1 -27.53 0.6 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -178.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 61.7 m -81.88 -41.15 21.37 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.702 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.9 m -71.65 -51.18 34.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -178.056 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.618 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.8 mp -82.8 147.51 5.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-O 120.965 0.412 . . . . 0.0 111.182 -179.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -138.38 166.58 23.87 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.04 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -107.64 99.77 9.23 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.074 0.464 . . . . 0.0 110.629 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.5 t -98.36 97.11 5.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.868 179.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.498 ' O ' HG22 ' A' ' 25' ' ' THR . 34.2 t0 52.83 33.2 13.75 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 111.729 0.27 . . . . 0.0 111.729 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.24 28.72 11.2 Favored Glycine 0 C--N 1.331 0.267 0 C-N-CA 120.581 -0.819 . . . . 0.0 113.371 179.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 54.1 p -141.1 134.96 30.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.925 0.393 . . . . 0.0 111.289 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.427 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 41.1 mt -73.31 119.16 17.16 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.681 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 7.3 mttm -125.21 139.32 53.84 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.639 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -80.64 -53.78 6.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.59 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.211 -0.9 . . . . 0.0 110.769 179.746 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.446 -0.261 . . . . 0.0 112.446 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 7.0 tt -109.12 -61.6 1.6 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.817 0.342 . . . . 0.0 110.972 -179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -71.83 148.68 43.55 Favored Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.873 -0.679 . . . . 0.0 112.843 -179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.2 mtmt -150.62 82.73 1.35 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.865 0.364 . . . . 0.0 110.442 179.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.456 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 15.6 p90 -91.16 -40.4 11.59 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.855 -179.579 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.91 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.0 tp -61.77 -20.76 24.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-O 120.663 0.268 . . . . 0.0 111.618 -179.426 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -75.92 -23.92 55.53 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.198 179.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.0 p -118.17 8.43 12.36 Favored 'General case' 0 CA--C 1.53 0.209 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 m -125.39 154.86 41.25 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.077 0.465 . . . . 0.0 111.226 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.2 173.18 11.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.814 -179.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.416 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.8 p-10 49.18 58.13 5.72 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 121.005 0.431 . . . . 0.0 112.152 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.609 HG21 ' CD1' ' A' ' 5' ' ' ILE . 9.9 p -79.57 131.98 36.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.784 178.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.742 ' O ' HD12 ' A' ' 19' ' ' LEU . 11.5 pt20 -157.45 163.72 38.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.448 -179.713 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.745 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.37 136.72 37.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.841 -179.65 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.85 143.9 47.65 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.435 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.35 -151.01 36.49 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 119.927 -1.13 . . . . 0.0 111.522 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.28 -37.2 18.8 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -178.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.463 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.18 35.86 1.53 Allowed 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -179.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -114.36 149.99 35.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.02 0.438 . . . . 0.0 111.806 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.767 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.3 tp -123.56 124.22 42.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.546 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.42 144.31 47.01 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.865 0.364 . . . . 0.0 110.196 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.38 172.24 16.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.373 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -111.52 134.12 53.31 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 177.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 64.2 m -131.01 132.32 44.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.141 0.496 . . . . 0.0 112.103 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.433 ' HB3' ' CE2' ' A' ' 30' ' ' PHE . 1.9 ptpt -66.41 136.93 56.45 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.219 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.474 HG22 ' O ' ' A' ' 95' ' ' ASP . 82.6 p -85.86 -178.47 6.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.626 -0.715 . . . . 0.0 110.481 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 29.9 mtt180 -60.82 -30.06 69.85 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.766 0.317 . . . . 0.0 111.03 -179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.78 9.06 8.6 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 66.96 37.32 3.93 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.145 0.497 . . . . 0.0 111.635 -178.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 47.0 mt-30 -118.5 135.46 54.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.009 177.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.433 ' CE2' ' HB3' ' A' ' 24' ' ' LYS . 77.5 m-85 -92.34 124.61 36.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.994 0.426 . . . . 0.0 111.879 -178.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.6 m -129.88 148.24 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.295 179.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 48.4 t -70.14 136.49 50.18 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.305 0.574 . . . . 0.0 111.814 -178.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.7 t -143.14 161.53 37.96 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.994 179.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.3 ttpt -142.6 157.12 45.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.289 0.566 . . . . 0.0 111.901 -179.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.462 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -138.6 127.13 29.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.29 179.592 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.8 t-20 -87.68 117.02 26.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.629 0.252 . . . . 0.0 111.511 -178.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.84 HD22 HD22 ' A' ' 69' ' ' LEU . 4.2 mp -86.11 -16.18 38.8 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.61 178.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.437 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -55.08 -48.03 74.09 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.886 -178.625 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.439 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.6 OUTLIER -92.08 -10.06 40.42 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 122.26 -0.275 . . . . 0.0 111.508 179.536 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.415 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 23.4 m-70 -96.5 -69.54 0.75 Allowed 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.621 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.8 mp -79.34 151.36 4.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.137 178.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.421 ' HB1' ' OG ' ' A' ' 53' ' ' SER . . . -141.74 172.38 12.77 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.956 -178.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.51 ' C ' HD12 ' A' ' 44' ' ' ILE . 23.2 t30 -112.82 113.1 25.04 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.971 -179.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.887 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.6 mp -113.25 89.95 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-O 120.818 0.342 . . . . 0.0 111.327 179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 39.6 t0 69.32 38.77 1.78 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.587 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.15 3.37 88.97 Favored Glycine 0 CA--C 1.519 0.298 0 C-N-CA 120.598 -0.81 . . . . 0.0 113.061 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 52.1 m -115.89 137.4 52.14 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.944 0.402 . . . . 0.0 111.124 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 53.9 mt -77.45 116.64 18.2 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.569 0.699 . . . . 0.0 111.925 -177.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.887 ' HB2' HD13 ' A' ' 44' ' ' ILE . 38.3 mttt -137.22 162.56 33.16 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 114.701 -1.136 . . . . 0.0 109.527 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.728 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 6.1 m-90 -87.67 124.1 33.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.103 0.478 . . . . 0.0 112.062 -179.063 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.441 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 12.6 tt0 -176.33 149.72 0.97 Allowed Pre-proline 0 C--N 1.332 -0.184 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.179 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.441 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 12.3 Cg_exo -67.94 66.15 0.93 Allowed 'Trans proline' 0 C--N 1.35 0.631 0 C-N-CA 122.27 1.98 . . . . 0.0 112.485 -179.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.421 ' OG ' ' HB1' ' A' ' 42' ' ' ALA . 3.1 p -155.92 135.44 12.44 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.726 178.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.435 ' N ' ' ND2' ' A' ' 54' ' ' ASN . 0.0 OUTLIER -82.62 106.6 14.61 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.216 0.532 . . . . 0.0 112.313 -177.701 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.463 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 33.8 p90 -47.78 -30.18 3.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.532 178.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.6 p -49.35 -18.03 0.33 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 115.584 -0.734 . . . . 0.0 112.893 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.5 mm-40 -64.78 -26.93 68.56 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.569 0.223 . . . . 0.0 111.6 -178.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.487 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.3 p -128.68 -3.42 5.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.558 0.218 . . . . 0.0 111.485 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.8 m -109.2 148.96 30.09 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.207 0.527 . . . . 0.0 111.894 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.4 p90 -142.23 157.35 44.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.946 -179.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.6 m-20 63.21 45.44 5.08 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.043 0.449 . . . . 0.0 110.75 -179.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.745 ' O ' HD22 ' A' ' 13' ' ' LEU . 21.4 m -69.25 137.08 52.83 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.604 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -141.38 151.17 43.28 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.489 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.542 HG21 HD13 ' A' ' 19' ' ' LEU . 24.3 mt -129.29 140.27 49.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.297 0.57 . . . . 0.0 111.823 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 17.1 mt-30 -136.77 108.92 7.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.238 -0.892 . . . . 0.0 108.98 179.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.75 -120.53 11.13 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.264 -0.97 . . . . 0.0 111.077 -178.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.438 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 20.6 p -103.33 -0.86 29.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.808 0.304 . . . . 0.0 111.514 -179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.492 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.7 t -103.61 139.11 25.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.142 0 CA-C-O 120.934 0.397 . . . . 0.0 111.709 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.84 HD22 HD22 ' A' ' 37' ' ' LEU . 11.6 tp -103.94 124.9 49.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.345 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 4.3 m -114.86 125.22 53.41 Favored 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -152.13 153.88 34.77 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.625 0.25 . . . . 0.0 111.438 -178.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.4 m -94.26 125.8 39.11 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.052 -0.721 . . . . 0.0 109.052 178.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 96.1 m -123.87 142.38 51.17 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.829 0.678 . . . . 0.0 112.829 -178.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -73.7 137.31 43.98 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.873 178.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 18.7 mtm180 -91.45 142.39 27.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.694 0.283 . . . . 0.0 110.322 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.9 m -52.0 -28.99 18.87 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.903 0.334 . . . . 0.0 111.903 -179.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -83.73 3.82 31.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.656 0.265 . . . . 0.0 111.641 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.92 135.65 7.37 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.892 -0.67 . . . . 0.0 112.905 179.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.35 -171.95 14.0 Favored Glycine 0 C--N 1.319 -0.378 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -178.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 45.0 m-85 -131.28 144.02 50.98 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 117.308 0.554 . . . . 0.0 111.263 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -154.2 129.53 9.77 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.302 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.6 t -92.54 134.88 34.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.74 -179.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 81.3 p -122.35 158.07 30.43 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.317 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.9 m -122.9 144.06 49.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.871 0.367 . . . . 0.0 111.148 -179.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.728 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.5 tt -145.65 143.99 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.895 -179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -97.58 116.3 29.52 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.798 179.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.636 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 6.0 mt -98.31 -6.64 30.53 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -179.204 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.91 ' ND2' HG22 ' A' ' 5' ' ' ILE . 6.8 t-20 -44.98 -27.98 0.61 Allowed 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 -178.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.0 t -81.93 -39.81 23.22 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.721 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -72.49 -52.08 25.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -178.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.553 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.53 147.64 5.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.007 0.432 . . . . 0.0 110.86 -179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.413 ' N ' ' O ' ' A' ' 99' ' ' LYS . 10.9 tt0 -139.31 166.71 23.83 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.207 -178.612 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -107.5 99.94 9.4 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.101 0.477 . . . . 0.0 110.662 -179.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.491 HG21 ' HG3' ' A' ' 99' ' ' LYS . 61.7 t -100.38 97.96 6.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.04 179.254 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.474 ' O ' HG22 ' A' ' 25' ' ' THR . 25.1 t0 53.53 32.03 13.47 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.656 0.265 . . . . 0.0 111.672 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.93 28.55 10.85 Favored Glycine 0 C--N 1.331 0.256 0 C-N-CA 120.619 -0.801 . . . . 0.0 113.369 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 36.1 t -140.93 134.45 29.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.902 0.382 . . . . 0.0 111.193 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.41 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 42.9 mt -73.01 119.51 17.36 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.75 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.491 ' HG3' HG21 ' A' ' 94' ' ' VAL . 26.2 mmtt -122.99 132.17 54.02 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.072 -179.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.415 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 13.2 t80 -80.48 -34.13 36.09 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.61 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.327 -0.844 . . . . 0.0 111.069 179.76 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.217 0 N-CA-C 112.405 -0.278 . . . . 0.0 112.405 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.469 ' O ' HD12 ' A' ' 1' ' ' LEU . 3.5 pp -88.09 125.28 34.49 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.837 0.351 . . . . 0.0 110.507 179.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 88.45 -125.57 7.74 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.064 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 7.9 mttt 60.56 51.08 5.3 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.762 0.315 . . . . 0.0 110.747 179.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.485 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 18.2 p90 -88.05 -41.06 13.34 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.075 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.981 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.3 tp -62.22 -22.31 28.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-O 120.778 0.323 . . . . 0.0 111.239 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.3 mt-10 -73.06 -24.43 60.69 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.832 0.349 . . . . 0.0 110.852 179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 37.7 p -119.19 17.37 13.17 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 120.871 0.367 . . . . 0.0 111.723 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 85.9 m -133.21 155.28 49.63 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.0 0.428 . . . . 0.0 110.919 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.0 ptt85 -135.64 172.93 12.3 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.403 -179.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.428 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.1 p-10 48.29 57.93 5.68 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.736 -0.666 . . . . 0.0 112.445 -179.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.719 HG21 ' CD1' ' A' ' 5' ' ' ILE . 22.0 p -78.99 135.55 36.94 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.05 178.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.721 ' O ' HD12 ' A' ' 19' ' ' LEU . 0.1 OUTLIER -158.91 163.52 36.48 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.039 0.447 . . . . 0.0 111.678 -179.407 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.734 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.61 136.5 37.91 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.807 179.897 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.9 143.14 48.11 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.407 179.084 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 57.61 -149.14 33.4 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 119.944 -1.122 . . . . 0.0 111.887 -179.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -87.3 -37.77 16.87 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -177.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.8 p -141.62 36.36 1.64 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -178.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -115.93 149.64 38.4 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.257 0.551 . . . . 0.0 111.976 178.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.821 ' CB ' HD11 ' A' ' 37' ' ' LEU . 14.0 tp -123.49 123.79 41.43 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.768 178.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.91 142.68 47.07 Favored 'General case' 0 N--CA 1.453 -0.306 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.64 172.78 15.71 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.523 -178.415 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -113.36 134.12 54.8 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 177.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.404 ' SG ' HD21 ' A' ' 98' ' ' LEU . 83.9 m -131.19 132.84 44.98 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.924 0.392 . . . . 0.0 111.82 -179.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 5.2 ptpt -64.63 138.9 58.66 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.228 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.466 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.5 p -86.97 -176.87 5.9 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.506 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -61.02 -30.65 70.43 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.884 0.373 . . . . 0.0 111.277 -179.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.13 10.48 8.13 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 -178.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 67.43 37.72 3.41 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.165 0.507 . . . . 0.0 111.216 -178.572 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -119.06 133.58 55.72 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.363 178.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.434 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 34.3 m-85 -91.3 125.42 36.06 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.115 0.483 . . . . 0.0 112.101 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.9 m -128.65 151.64 35.71 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.934 179.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.5 p -71.29 132.89 45.56 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.263 0.554 . . . . 0.0 111.784 -178.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.0 t -142.09 162.35 35.71 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.183 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -144.11 154.7 43.46 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.378 0.608 . . . . 0.0 111.85 -179.008 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.76 125.78 41.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 108.488 -0.93 . . . . 0.0 108.488 179.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -88.02 117.49 26.93 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.952 -178.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.821 HD11 ' CB ' ' A' ' 19' ' ' LEU . 3.4 mp -87.87 -15.87 35.53 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.0 p-10 -57.72 -44.86 86.28 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -177.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.434 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 3.5 m-20 -91.86 -9.97 41.42 Favored 'General case' 0 C--N 1.329 -0.321 0 O-C-N 122.047 -0.408 . . . . 0.0 111.247 179.066 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.436 ' CE1' ' HB2' ' A' ' 100' ' ' TYR . 14.3 m-70 -93.28 -63.55 1.2 Allowed 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.13 -0.692 . . . . 0.0 109.13 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.645 ' CD1' HD23 ' A' ' 37' ' ' LEU . 34.9 mt -83.05 154.03 3.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.965 178.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.59 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -142.0 171.89 13.44 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.257 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.604 ' C ' HD12 ' A' ' 44' ' ' ILE . 25.8 t30 -112.6 111.36 22.12 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.618 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.813 HD13 ' HB2' ' A' ' 49' ' ' LYS . 1.9 mp -111.7 88.56 1.14 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-O 121.05 0.452 . . . . 0.0 110.736 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 52.3 t0 67.91 39.39 2.58 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.16 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.1 2.68 90.56 Favored Glycine 0 CA--C 1.521 0.41 0 C-N-CA 120.741 -0.743 . . . . 0.0 113.348 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.6 m -109.92 136.38 49.29 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 117.199 0.499 . . . . 0.0 111.264 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.425 HD12 ' O ' ' A' ' 83' ' ' SER . 23.6 mt -77.1 116.29 17.62 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.701 0.762 . . . . 0.0 111.465 -178.072 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.813 ' HB2' HD13 ' A' ' 44' ' ' ILE . 41.3 mttt -139.43 163.52 32.31 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.684 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.799 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 9.5 m-90 -88.64 127.52 35.57 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.113 0.412 . . . . 0.0 112.113 -179.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.59 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.6 OUTLIER -174.46 151.96 1.65 Allowed Pre-proline 0 N--CA 1.469 0.519 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.539 -179.772 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.434 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 63.7 Cg_endo -74.12 66.17 5.2 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 121.945 1.763 . . . . 0.0 112.485 -179.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -162.36 133.2 4.94 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.7 -1.136 . . . . 0.0 107.969 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.1 114.22 17.86 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 -177.219 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 39.5 p90 -48.95 -29.24 4.56 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.386 177.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.6 p -49.83 -18.89 0.56 Allowed 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.271 -0.877 . . . . 0.0 113.356 -178.638 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -60.8 -26.53 67.37 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 120.897 -0.321 . . . . 0.0 110.639 -179.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.407 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.5 p -131.16 1.65 4.23 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 179.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.1 m -113.76 147.35 38.44 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.298 0.57 . . . . 0.0 112.481 -178.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.3 p90 -141.24 157.91 44.61 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.073 179.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 64.99 45.71 3.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.997 0.427 . . . . 0.0 111.39 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.734 ' O ' HD22 ' A' ' 13' ' ' LEU . 46.4 m -67.82 135.51 52.69 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.639 179.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.494 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.56 151.8 41.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.561 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.483 ' CG1' HD13 ' A' ' 69' ' ' LEU . 48.3 mt -130.15 139.75 50.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.315 0.579 . . . . 0.0 111.907 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -134.05 109.09 8.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.932 179.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 65.59 -119.37 13.77 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.215 -0.993 . . . . 0.0 111.205 -178.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 19.4 p -101.53 -5.59 24.97 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.6 t -101.03 138.27 25.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-O 120.872 0.368 . . . . 0.0 111.583 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.817 HD22 HD22 ' A' ' 37' ' ' LEU . 7.7 tp -101.12 125.7 47.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.138 179.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.483 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.0 m -115.07 125.55 53.66 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.8 t -151.4 153.16 34.17 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.331 -178.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.437 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.4 m -93.91 126.0 38.86 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 179.155 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 89.7 m -126.58 144.6 50.84 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -178.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -73.36 134.99 44.25 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.48 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.0 mtp85 -92.09 142.88 27.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.647 0.26 . . . . 0.0 110.654 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 33.1 m -51.54 -28.2 13.04 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.67 -178.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -82.11 1.87 34.01 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.538 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.81 133.72 6.53 Favored Glycine 0 C--N 1.332 0.36 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.997 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.3 -167.48 12.5 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -130.89 142.15 50.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.797 0.298 . . . . 0.0 111.178 -179.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -154.74 130.79 10.23 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.685 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.437 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -93.82 134.46 36.15 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.102 0.477 . . . . 0.0 111.574 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.425 ' O ' HD12 ' A' ' 48' ' ' LEU . 24.3 p -120.67 158.93 26.36 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.636 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.3 p -123.92 145.85 48.86 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.859 0.361 . . . . 0.0 111.191 -179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.799 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 15.2 tt -144.89 143.33 22.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.637 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -96.92 116.93 30.05 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.419 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.621 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 6.9 mt -95.83 -4.71 43.28 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -178.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.981 ' ND2' HG22 ' A' ' 5' ' ' ILE . 11.9 t-20 -43.76 -29.31 0.51 Allowed 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -178.289 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.3 m -81.77 -40.43 22.65 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.697 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.5 m -70.86 -53.17 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 N-CA-C 113.506 0.928 . . . . 0.0 113.506 -177.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.579 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -83.13 145.29 8.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.281 0.562 . . . . 0.0 112.052 -178.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.409 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 16.1 tt0 -135.75 165.49 25.47 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.942 -178.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -107.18 99.84 9.35 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.971 0.415 . . . . 0.0 111.141 -179.6 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 25.7 t -99.53 99.34 8.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.798 178.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.466 ' O ' HG22 ' A' ' 25' ' ' THR . 28.9 t0 53.08 32.09 12.39 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.773 -179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.15 28.83 10.26 Favored Glycine 0 C--N 1.329 0.144 0 C-N-CA 120.579 -0.82 . . . . 0.0 113.149 178.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.7 t -141.01 135.95 31.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.864 0.364 . . . . 0.0 111.029 -179.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.409 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 67.5 mt -74.6 121.3 21.38 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.0 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -127.24 137.21 52.83 Favored 'General case' 0 N--CA 1.463 0.175 0 CA-C-O 121.065 0.46 . . . . 0.0 112.202 -179.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.436 ' HB2' ' CE1' ' A' ' 40' ' ' HIS . 35.8 t80 -75.95 -41.97 49.93 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.686 179.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.153 -0.927 . . . . 0.0 111.087 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.192 0 N-CA-C 112.413 -0.275 . . . . 0.0 112.413 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.426 HD23 ' N ' ' A' ' 2' ' ' GLY . 1.4 tt -105.25 129.92 53.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.804 0.335 . . . . 0.0 110.762 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.426 ' N ' HD23 ' A' ' 1' ' ' LEU . . . 61.53 -105.52 0.92 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.684 -0.77 . . . . 0.0 112.457 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 19.2 mttt 60.61 66.75 0.89 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.855 0.36 . . . . 0.0 110.899 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.453 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 23.1 p90 -92.75 -38.26 11.9 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.312 179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.953 HG22 ' ND2' ' A' ' 88' ' ' ASN . 7.3 tp -65.5 -15.68 19.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-O 120.696 0.284 . . . . 0.0 111.334 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -75.4 -25.24 57.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.764 0.316 . . . . 0.0 110.659 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.9 p -118.8 18.19 13.36 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.465 179.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 67.2 m -133.41 154.76 50.5 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.947 0.403 . . . . 0.0 111.441 -179.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -133.69 172.74 12.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.174 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 49.0 57.77 6.09 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.012 -0.54 . . . . 0.0 112.209 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.675 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.2 p -79.39 133.11 36.57 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 178.394 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.647 ' O ' HD12 ' A' ' 19' ' ' LEU . 18.5 pt20 -157.76 163.77 37.75 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.399 -178.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.739 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.35 135.4 39.31 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.574 179.748 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -118.9 143.54 46.94 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.195 179.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.69 -151.49 33.06 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 119.891 -1.147 . . . . 0.0 111.465 -178.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.64 -37.19 18.27 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 -178.087 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.8 35.24 1.78 Allowed 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.6 mp0 -115.91 146.96 41.61 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.017 0.437 . . . . 0.0 111.775 179.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.794 ' CB ' HD11 ' A' ' 37' ' ' LEU . 10.2 tp -119.75 124.91 47.35 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 178.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.89 143.58 47.87 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.922 0.392 . . . . 0.0 110.486 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.35 172.46 16.53 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.164 -178.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.33 133.88 54.18 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 177.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.6 m -130.54 133.16 46.01 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.255 0.55 . . . . 0.0 111.935 -178.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 4.5 ptpt -66.45 136.05 55.15 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.273 -179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.432 HG22 ' O ' ' A' ' 95' ' ' ASP . 69.2 p -85.29 -177.59 6.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.577 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.0 mmt85 -60.8 -29.7 69.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.681 0.276 . . . . 0.0 111.263 -179.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.11 9.32 10.67 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -178.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 18.1 mt-30 66.68 37.84 4.18 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.159 0.504 . . . . 0.0 111.528 -178.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.422 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 67.6 mt-30 -117.22 135.83 53.51 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 177.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -92.42 125.16 36.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.908 0.385 . . . . 0.0 111.836 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.6 m -130.37 151.19 35.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.819 179.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 19.8 m -72.1 134.19 45.64 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.194 0.521 . . . . 0.0 111.558 -178.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.2 t -142.68 161.45 38.05 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.188 179.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -142.82 156.34 44.94 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.473 0.654 . . . . 0.0 112.276 -179.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.514 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -136.47 124.42 34.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 114.904 -1.044 . . . . 0.0 108.468 179.127 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -87.75 119.55 28.19 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.717 0.294 . . . . 0.0 110.752 -178.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.805 HD22 HD22 ' A' ' 69' ' ' LEU . 4.1 mp -88.84 -14.86 35.94 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.462 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 6.4 p-10 -56.04 -46.54 78.83 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.462 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.1 p30 -92.36 -10.0 39.78 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 122.081 -0.387 . . . . 0.0 111.564 179.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -96.33 -64.6 1.03 Allowed 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.576 HD13 ' CD1' ' A' ' 50' ' ' TRP . 33.0 mm -80.52 147.54 6.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.541 178.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.418 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -141.18 171.55 13.91 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.772 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.556 ' C ' HD12 ' A' ' 44' ' ' ILE . 22.7 t30 -113.18 112.53 23.94 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.033 -179.321 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.736 HD13 ' HB2' ' A' ' 49' ' ' LYS . 1.9 mp -110.61 89.4 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.726 179.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 52.7 t0 67.55 39.39 2.84 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.402 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.74 0.75 87.63 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.674 -0.774 . . . . 0.0 113.263 179.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.1 m -112.63 135.28 53.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.15 0.475 . . . . 0.0 110.632 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 15.1 mt -77.34 118.9 20.27 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.553 0.692 . . . . 0.0 111.305 -178.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.736 ' HB2' HD13 ' A' ' 44' ' ' ILE . 17.9 mttt -136.82 162.75 32.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.851 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.774 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.2 m-90 -85.54 119.83 26.32 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.941 0.4 . . . . 0.0 110.94 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.417 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 29.8 tt0 -173.77 148.31 1.43 Allowed Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.28 -179.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.417 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 13.0 Cg_exo -67.22 65.53 0.67 Allowed 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.317 2.011 . . . . 0.0 112.833 -179.055 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.418 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.2 p -157.63 134.35 9.91 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.823 178.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.434 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.0 109.28 15.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.125 0.488 . . . . 0.0 112.059 -178.034 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.432 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 32.7 p90 -48.45 -29.09 3.72 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.532 178.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 70.8 p -48.65 -19.34 0.34 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.693 -0.685 . . . . 0.0 112.687 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -62.36 -25.25 67.81 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 121.066 -0.254 . . . . 0.0 111.271 -179.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.451 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -133.82 3.4 3.49 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.2 m -115.36 149.49 37.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.269 0.557 . . . . 0.0 112.34 -178.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -143.03 157.81 44.18 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.262 -0.881 . . . . 0.0 109.782 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 61.5 m-20 64.28 46.19 3.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.903 0.383 . . . . 0.0 110.512 -178.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.739 ' O ' HD22 ' A' ' 13' ' ' LEU . 72.4 m -70.12 135.33 49.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.689 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.478 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.63 152.04 42.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.768 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.468 ' CG1' HD13 ' A' ' 69' ' ' LEU . 22.0 mt -129.71 140.18 49.71 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-O 121.305 0.574 . . . . 0.0 111.762 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -135.6 108.92 7.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.044 179.038 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.94 -120.99 13.18 Favored Glycine 0 N--CA 1.449 -0.463 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.081 -178.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.421 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.8 p -102.11 -3.93 26.73 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.416 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.5 t -101.83 139.95 21.66 Favored 'Isoleucine or valine' 0 C--O 1.232 0.17 0 CA-C-O 120.902 0.382 . . . . 0.0 111.561 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.805 HD22 HD22 ' A' ' 37' ' ' LEU . 5.6 tp -104.08 128.88 51.73 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.854 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.631 ' N ' HD12 ' A' ' 69' ' ' LEU . 7.5 m -118.09 127.11 53.47 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.417 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.5 t -151.93 153.34 33.92 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.276 -179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.7 m -94.59 125.83 39.49 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 78.8 m -126.18 144.56 50.72 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.738 0.644 . . . . 0.0 112.738 -178.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.62 137.31 42.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.158 -0.928 . . . . 0.0 110.645 178.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 41.0 mtp85 -92.56 144.64 25.13 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.706 0.289 . . . . 0.0 110.591 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.3 m -51.87 -28.06 14.78 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.7 -179.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -83.43 1.95 39.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.667 0.27 . . . . 0.0 111.554 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.29 136.97 7.17 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.655 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.39 -171.27 13.69 Favored Glycine 0 C--N 1.32 -0.352 0 N-CA-C 111.131 -0.788 . . . . 0.0 111.131 -178.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -130.06 141.12 50.75 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 117.296 0.548 . . . . 0.0 111.212 -179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -153.93 130.67 10.8 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.232 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.477 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.2 t -93.57 134.95 35.33 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.681 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 92.3 p -123.24 158.33 31.12 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.298 179.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.1 p -123.42 146.47 47.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.257 -179.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.716 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 14.1 tt -145.41 143.1 22.15 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.584 179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -95.79 119.13 33.73 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.971 179.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.545 ' HB3' HD12 ' A' ' 91' ' ' ILE . 10.9 mt -99.26 -5.65 29.46 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -178.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.953 ' ND2' HG22 ' A' ' 5' ' ' ILE . 12.4 t-20 -44.75 -28.2 0.6 Allowed 'General case' 0 N--CA 1.467 0.404 0 O-C-N 122.081 -0.387 . . . . 0.0 111.982 -178.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 40.0 t -82.35 -40.06 21.91 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.69 0.626 . . . . 0.0 112.69 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.774 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -72.4 -53.0 20.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 113.247 0.832 . . . . 0.0 113.247 -178.052 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.654 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -83.41 147.44 5.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.017 0.437 . . . . 0.0 111.339 -179.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' A' ' 99' ' ' LYS . 11.9 tt0 -138.33 165.86 25.68 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.974 -178.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -108.45 100.13 9.44 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.156 0.503 . . . . 0.0 110.586 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.9 t -98.97 98.59 7.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.072 179.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.432 ' O ' HG22 ' A' ' 25' ' ' THR . 26.2 t0 53.06 33.74 15.62 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 111.752 0.278 . . . . 0.0 111.752 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.46 28.56 12.59 Favored Glycine 0 CA--C 1.518 0.223 0 C-N-CA 120.658 -0.782 . . . . 0.0 113.344 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.8 m -140.68 136.07 32.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.861 0.362 . . . . 0.0 111.296 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.42 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 59.3 mt -74.39 119.25 18.34 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.56 179.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.423 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.5 mmtt -125.17 138.23 54.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.374 -179.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.453 ' CE1' ' HB ' ' A' ' 90' ' ' VAL . 89.0 t80 -77.47 162.0 27.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.344 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.428 ' HG3' ' CE2' ' A' ' 100' ' ' TYR . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.886 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 112.716 -0.154 . . . . 0.0 112.716 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 1' ' ' LEU . 13.7 tp -112.78 -43.5 3.43 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.685 0.278 . . . . 0.0 111.015 179.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -164.4 -121.17 0.55 Allowed Glycine 0 CA--C 1.52 0.377 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.959 -179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 49.3 mttt 64.9 68.55 0.51 Allowed 'General case' 0 N--CA 1.463 0.178 0 CA-C-O 120.874 0.369 . . . . 0.0 110.949 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.446 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 30.1 p90 -93.49 -39.95 10.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.648 -179.609 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.891 HG22 ' ND2' ' A' ' 88' ' ' ASN . 7.5 tp -63.49 -17.29 19.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.912 -179.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.76 -26.82 57.75 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.943 178.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.9 p -118.96 20.8 12.66 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.283 179.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 65.7 m -136.34 154.74 50.76 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.033 0.444 . . . . 0.0 111.407 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 1.9 ptm85 -133.78 173.16 11.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.192 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.5 p-10 48.85 57.82 5.99 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.072 -0.513 . . . . 0.0 112.106 -179.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.616 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.1 p -79.06 131.96 36.44 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 178.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.746 ' O ' HD12 ' A' ' 19' ' ' LEU . 6.4 pt20 -157.56 164.02 37.76 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.892 0.377 . . . . 0.0 111.743 -178.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.711 HD22 ' O ' ' A' ' 62' ' ' SER . 0.9 OUTLIER -97.41 136.01 38.47 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.056 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.11 143.84 47.95 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.63 -151.78 32.21 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 119.797 -1.192 . . . . 0.0 111.608 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.0 -37.5 18.9 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -178.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.419 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -142.12 36.56 1.55 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -178.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -115.51 147.29 40.83 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.985 0.421 . . . . 0.0 111.704 178.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.781 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.0 tp -120.55 123.66 43.42 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.646 ' HB2' ' HE2' ' A' ' 34' ' ' LYS . . . -118.55 143.85 46.47 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.4 172.74 15.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.522 -178.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -112.34 133.55 54.38 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 177.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 84.5 m -130.8 133.97 46.44 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.258 0.466 . . . . 0.0 112.258 -179.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 30' ' ' PHE . 8.5 ptpt -66.51 134.86 53.28 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.011 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.527 HG22 ' O ' ' A' ' 95' ' ' ASP . 70.8 p -84.05 -176.2 6.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.504 -179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.25 -30.5 70.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.753 0.311 . . . . 0.0 111.036 -179.685 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.64 10.04 8.28 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 66.89 37.77 3.9 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.151 0.5 . . . . 0.0 111.778 -179.05 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.431 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 66.6 mt-30 -120.32 135.19 55.1 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.015 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.434 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 30.4 m-85 -92.93 125.09 37.36 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.136 0.493 . . . . 0.0 111.708 -178.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 22.9 m -128.25 153.08 37.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.607 179.646 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 42.7 m -72.65 134.37 45.07 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.144 0.497 . . . . 0.0 111.807 -178.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.5 t -144.38 161.55 38.72 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.349 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.646 ' HE2' ' HB2' ' A' ' 20' ' ' ALA . 12.1 ttmt -144.29 156.47 44.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.21 0.529 . . . . 0.0 111.895 -179.157 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.422 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.3 tp -134.91 129.76 51.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.027 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -88.98 115.48 26.58 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.63 0.252 . . . . 0.0 111.48 -178.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.878 HD22 HD22 ' A' ' 69' ' ' LEU . 4.0 mp -87.0 -14.99 40.05 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.542 -0.299 . . . . 0.0 111.511 179.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -46.18 79.2 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 -178.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -92.23 -10.0 40.15 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.874 0.324 . . . . 0.0 111.874 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.7 m-70 -96.7 -64.93 1.0 Allowed 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.548 HD11 HD22 ' A' ' 87' ' ' LEU . 21.1 mm -79.86 146.03 8.36 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.537 178.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -137.82 171.34 14.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.804 -179.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.426 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 28.9 t30 -111.4 108.01 17.43 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.618 -179.336 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.5 mm -108.65 89.06 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.645 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 54.8 t0 66.13 39.0 4.47 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.305 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.14 0.47 89.58 Favored Glycine 0 CA--C 1.519 0.32 0 C-N-CA 120.872 -0.68 . . . . 0.0 113.32 179.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 52.6 m -110.16 136.36 49.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.077 0.439 . . . . 0.0 110.78 179.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 51.2 mt -77.23 117.52 18.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.639 0.733 . . . . 0.0 111.359 -178.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 71.9 mttt -137.57 162.54 33.5 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 114.706 -1.134 . . . . 0.0 110.354 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.731 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.9 m-90 -86.91 119.3 26.98 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.992 0.425 . . . . 0.0 111.072 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.42 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 32.4 tt0 -173.05 143.24 1.08 Allowed Pre-proline 0 N--CA 1.464 0.252 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.658 -179.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.42 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 32.0 Cg_endo -64.72 72.59 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.019 1.812 . . . . 0.0 112.544 -179.006 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.2 p -162.85 136.01 5.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 114.87 -1.059 . . . . 0.0 108.882 179.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -83.01 109.88 17.48 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -178.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.423 ' CB ' ' HB2' ' A' ' 43' ' ' ASN . 29.4 p90 -49.95 -30.31 10.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.919 178.539 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 78.1 p -49.17 -18.58 0.35 Allowed 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 113.516 0.932 . . . . 0.0 113.516 -178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -63.22 -25.49 68.36 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.853 -0.339 . . . . 0.0 111.455 -178.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.426 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 4.8 p -131.5 -0.64 3.96 Favored 'General case' 0 C--N 1.331 -0.21 0 C-N-CA 121.015 -0.274 . . . . 0.0 111.545 179.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.3 m -109.72 148.62 31.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.113 0.482 . . . . 0.0 112.016 -178.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -142.4 157.38 44.84 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.684 -179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 21.5 m120 63.38 45.08 5.07 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.61 -179.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.711 ' O ' HD22 ' A' ' 13' ' ' LEU . 67.6 m -68.0 137.37 55.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.56 179.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.88 152.44 42.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.801 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.534 HG21 HD13 ' A' ' 19' ' ' LEU . 35.4 mt -130.93 139.29 51.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.291 0.567 . . . . 0.0 111.932 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -136.86 110.32 7.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.334 -0.848 . . . . 0.0 108.82 178.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 68.73 -121.54 12.53 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.466 -0.874 . . . . 0.0 111.202 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.422 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 21.8 p -101.61 -4.32 26.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -179.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.603 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.1 t -101.54 141.12 18.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.878 HD22 HD22 ' A' ' 37' ' ' LEU . 9.3 tp -102.71 123.53 46.57 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.439 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.402 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.3 m -114.46 124.4 51.83 Favored 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.3 t -152.15 153.8 34.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.63 0.252 . . . . 0.0 111.399 -178.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 16.3 m -94.85 126.56 40.25 Favored 'General case' 0 N--CA 1.456 -0.169 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 178.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 87.9 m -125.86 145.49 50.22 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -178.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -75.06 136.45 41.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.261 177.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 45.3 mtp180 -93.07 144.47 25.23 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.714 0.292 . . . . 0.0 110.944 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 46.8 m -52.21 -25.87 10.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.641 -179.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -82.36 0.28 42.54 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.76 0.314 . . . . 0.0 111.174 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.45 135.38 7.03 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.89 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 113.83 -166.04 12.11 Favored Glycine 0 C--N 1.319 -0.378 0 N-CA-C 111.447 -0.661 . . . . 0.0 111.447 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 68.4 m-85 -131.41 143.82 50.74 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 117.148 0.474 . . . . 0.0 111.295 -179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -154.25 130.79 10.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.267 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 2.0 t -94.31 134.88 36.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.664 -179.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 41.6 p -123.27 158.41 31.01 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.662 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.7 p -122.64 146.63 47.28 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.849 0.357 . . . . 0.0 111.174 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.674 HD11 ' CH2' ' A' ' 50' ' ' TRP . 12.9 tt -145.81 143.2 21.66 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.803 -179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -97.1 117.29 30.97 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.853 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.651 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 11.1 mt -98.78 -4.62 32.94 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -178.469 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.891 ' ND2' HG22 ' A' ' 5' ' ' ILE . 10.6 t-20 -44.77 -27.25 0.48 Allowed 'General case' 0 N--CA 1.469 0.515 0 O-C-N 122.0 -0.438 . . . . 0.0 112.101 -178.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.1 t -81.77 -41.94 20.47 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.731 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.0 m -70.72 -52.45 28.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -177.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.651 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -83.43 147.1 6.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-O 120.941 0.401 . . . . 0.0 111.58 -178.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 36.1 tt0 -137.71 164.29 29.23 Favored 'General case' 0 N--CA 1.462 0.157 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.886 -178.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -106.04 99.69 9.27 Favored 'General case' 0 C--O 1.231 0.119 0 CA-C-O 121.195 0.522 . . . . 0.0 110.697 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -98.05 97.56 6.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.29 179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.527 ' O ' HG22 ' A' ' 25' ' ' THR . 30.8 t0 52.46 32.29 11.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.61 0.243 . . . . 0.0 111.617 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.38 28.42 10.61 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.823 -0.703 . . . . 0.0 113.429 179.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 22.8 t -142.07 136.24 29.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.833 0.349 . . . . 0.0 111.463 -179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.466 HD22 HG21 ' A' ' 91' ' ' ILE . 78.9 mt -74.35 120.51 20.02 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.718 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 17.3 mttt -126.35 145.76 50.31 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.949 -178.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 53.3 t80 -73.62 -31.62 63.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.848 -0.615 . . . . 0.0 111.103 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 . . . . . 0 C--O 1.25 1.086 0 CA-C-O 118.242 -0.885 . . . . 0.0 111.097 -179.831 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.191 0 N-CA-C 112.534 -0.226 . . . . 0.0 112.534 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -168.07 35.25 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.903 0.382 . . . . 0.0 110.625 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -128.39 -79.61 0.26 Allowed Glycine 0 C--N 1.331 0.276 0 C-N-CA 120.937 -0.649 . . . . 0.0 112.27 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.423 ' HA ' ' ND2' ' A' ' 88' ' ' ASN . 53.6 mttt 63.09 73.42 0.46 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.884 0.373 . . . . 0.0 111.242 179.599 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 25.5 p90 -92.1 -38.46 12.17 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.409 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.967 HG22 ' ND2' ' A' ' 88' ' ' ASN . 5.1 tp -66.4 -14.6 17.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-O 120.713 0.292 . . . . 0.0 111.447 -179.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -77.29 -27.52 53.07 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.827 0.346 . . . . 0.0 110.683 179.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.9 p -118.68 19.11 13.3 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.258 179.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.6 m -133.1 154.48 50.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.04 0.448 . . . . 0.0 111.374 -179.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.59 172.41 12.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.925 -0.58 . . . . 0.0 110.964 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.8 p30 49.4 57.68 6.23 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.704 HG21 ' CD1' ' A' ' 5' ' ' ILE . 40.4 p -79.85 133.17 36.25 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 177.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.809 ' O ' HD12 ' A' ' 19' ' ' LEU . 8.5 pt20 -158.56 163.89 36.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.592 -179.234 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.703 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.56 136.47 37.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.268 0.556 . . . . 0.0 111.167 -179.745 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.22 143.26 48.36 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.282 179.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.14 -150.31 37.0 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 119.884 -1.15 . . . . 0.0 111.565 -179.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -86.29 -37.12 18.87 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -178.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.19 35.33 1.52 Allowed 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -178.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -114.67 149.65 36.4 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.986 0.422 . . . . 0.0 111.679 178.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.809 HD12 ' O ' ' A' ' 12' ' ' GLN . 14.2 tp -122.87 123.89 42.0 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -119.35 143.12 47.59 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.877 0.37 . . . . 0.0 110.212 179.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.82 172.86 15.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.255 -178.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -109.36 135.08 51.0 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 177.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 73.6 m -130.61 131.86 45.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.154 0.502 . . . . 0.0 111.415 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 0.4 OUTLIER -66.03 137.06 56.83 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.459 -179.491 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.489 HG22 ' O ' ' A' ' 95' ' ' ASP . 75.8 p -86.52 -178.15 6.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.481 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 12.3 mmt180 -60.38 -29.05 68.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.714 0.293 . . . . 0.0 111.247 -179.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.85 9.18 10.44 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 112.635 0.606 . . . . 0.0 112.635 -178.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 66.77 37.29 4.23 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.119 0.485 . . . . 0.0 111.393 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.467 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 27.3 mm-40 -118.18 137.81 52.74 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 177.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -93.15 125.04 37.54 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.946 0.403 . . . . 0.0 111.548 -178.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.414 HG22 HG23 ' A' ' 25' ' ' THR . 2.4 m -128.42 150.08 33.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.733 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 20.5 t -70.92 133.65 46.59 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.076 0.465 . . . . 0.0 111.41 -178.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 9.7 t -144.59 161.53 38.89 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.464 179.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? -143.1 157.91 44.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.396 0.617 . . . . 0.0 112.049 -179.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.433 ' HB ' ' CB ' ' A' ' 98' ' ' LEU . 1.1 tp -137.08 128.56 42.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.142 179.341 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -88.23 116.78 26.67 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 -178.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.949 HD22 HD22 ' A' ' 69' ' ' LEU . 4.6 mp -86.27 -14.44 43.72 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 121.046 -0.262 . . . . 0.0 110.544 178.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.406 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.1 OUTLIER -56.19 -48.91 75.44 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 112.251 0.464 . . . . 0.0 112.251 -178.461 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.83 -10.48 39.63 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 122.014 -0.429 . . . . 0.0 111.56 179.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.427 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 32.2 m-70 -96.07 -64.5 1.05 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.588 HD12 ' N ' ' A' ' 41' ' ' ILE . 2.1 mp -80.26 148.51 5.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.276 178.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.559 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -141.15 171.63 13.8 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.784 -179.308 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.542 ' C ' HD12 ' A' ' 44' ' ' ILE . 25.0 t30 -113.19 112.29 23.53 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.324 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.835 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.5 mp -112.97 89.28 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.141 179.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t0 68.43 37.02 2.78 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.252 179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.95 0.28 87.43 Favored Glycine 0 CA--C 1.52 0.373 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.425 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.3 m -109.81 135.02 51.37 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 117.254 0.527 . . . . 0.0 110.729 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 34.7 mt -77.31 116.56 18.02 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.838 0.828 . . . . 0.0 111.335 -177.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.835 ' HB2' HD13 ' A' ' 44' ' ' ILE . 61.0 mttt -139.42 163.57 32.16 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.193 -1.367 . . . . 0.0 109.109 179.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.704 ' CE2' HG11 ' A' ' 90' ' ' VAL . 9.5 m-90 -87.83 127.82 35.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.091 0.472 . . . . 0.0 112.246 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.559 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 1.5 mt-30 -172.57 152.21 2.54 Favored Pre-proline 0 N--CA 1.467 0.385 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.896 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -71.3 62.21 2.68 Favored 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 121.86 1.707 . . . . 0.0 112.029 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.51 135.34 10.76 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.141 -0.936 . . . . 0.0 108.633 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.403 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.77 110.99 16.8 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.274 0.472 . . . . 0.0 112.274 -177.852 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.466 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 39.5 p90 -48.32 -29.63 4.1 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.512 178.264 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 24.0 p -49.02 -17.82 0.24 Allowed 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -179.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -63.01 -28.67 70.26 Favored 'General case' 0 C--N 1.332 -0.166 0 O-C-N 122.163 -0.336 . . . . 0.0 111.141 -179.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.45 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -128.56 -0.05 5.55 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.582 -0.281 . . . . 0.0 111.522 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.3 m -111.47 148.73 32.51 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.316 0.579 . . . . 0.0 112.395 -178.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 19.8 p90 -143.3 157.86 44.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.132 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 74.7 m-20 63.64 45.34 4.65 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.013 0.435 . . . . 0.0 110.887 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.703 ' O ' HD22 ' A' ' 13' ' ' LEU . 74.9 m -70.33 137.26 50.48 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.828 179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.77 151.65 41.45 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.4 179.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.556 HG21 HD13 ' A' ' 19' ' ' LEU . 57.5 mt -130.58 141.18 46.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.353 0.597 . . . . 0.0 112.094 -179.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 11.1 mm-40 -137.0 109.05 7.16 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.318 178.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.412 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 67.38 -119.93 12.35 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.446 -0.883 . . . . 0.0 111.689 -178.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.45 ' HB3' HG21 ' A' ' 5' ' ' ILE . 25.8 p -100.69 -4.71 27.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -178.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.592 HG13 ' O ' ' A' ' 85' ' ' ILE . 11.0 t -103.18 140.59 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-O 121.041 0.448 . . . . 0.0 112.208 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.949 HD22 HD22 ' A' ' 37' ' ' LEU . 8.0 tp -103.37 126.93 50.79 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.516 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.483 ' N ' HD12 ' A' ' 69' ' ' LEU . 31.8 m -115.71 125.54 52.95 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 179.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 t -151.57 153.43 34.51 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.052 -0.259 . . . . 0.0 111.297 -179.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 6.2 m -95.02 126.0 40.06 Favored 'General case' 0 N--CA 1.455 -0.209 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.6 m -126.44 145.18 50.58 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -74.77 137.3 41.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.954 178.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 49.2 mtm180 -91.93 144.49 25.41 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.348 179.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 17.4 m -51.98 -27.03 11.96 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.579 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -82.85 1.55 38.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.354 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.96 137.82 7.4 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.943 -0.646 . . . . 0.0 112.314 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.75 -168.16 12.49 Favored Glycine 0 C--N 1.319 -0.386 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -178.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -133.7 143.32 48.44 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 117.379 0.59 . . . . 0.0 111.431 -179.532 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -154.14 131.28 11.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.185 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -93.48 134.46 35.72 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.612 -179.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 24.6 p -121.73 158.09 29.52 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.189 179.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 78.7 p -122.74 144.34 49.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.903 0.383 . . . . 0.0 111.136 -179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.687 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.8 tt -145.13 142.93 22.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.64 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -96.86 116.18 28.72 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.401 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.632 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 3.6 mt -96.71 -4.3 41.01 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -178.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.967 ' ND2' HG22 ' A' ' 5' ' ' ILE . 11.9 t-20 -44.45 -26.91 0.39 Allowed 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 16.0 m -81.86 -40.98 21.65 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.704 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.8 m -72.98 -52.64 21.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 113.485 0.921 . . . . 0.0 113.485 -177.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.519 ' N ' HG23 ' A' ' 90' ' ' VAL . 2.7 mp -81.83 147.57 6.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.042 0.448 . . . . 0.0 111.319 -179.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 20.0 tt0 -139.88 166.19 25.28 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.013 -178.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 39.7 t30 -106.8 99.61 9.17 Favored 'General case' 0 CA--C 1.522 -0.127 0 CA-C-O 121.207 0.527 . . . . 0.0 110.349 179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.8 t -98.46 98.0 6.71 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.616 179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.489 ' O ' HG22 ' A' ' 25' ' ' THR . 31.7 t0 53.57 33.23 15.86 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 -179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.93 28.41 12.11 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.766 -0.731 . . . . 0.0 113.79 179.05 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.6 m -141.38 137.89 32.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.907 0.384 . . . . 0.0 111.108 179.791 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.433 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 67.8 mt -73.91 119.66 18.42 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.365 179.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.428 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 16.3 mttt -123.92 139.27 54.13 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.844 -178.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.427 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 20.3 t80 -85.65 -54.43 4.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.233 179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.222 -0.894 . . . . 0.0 110.702 179.545 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.149 0 N-CA-C 112.546 -0.221 . . . . 0.0 112.546 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 11.5 tp -166.81 120.71 1.04 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.719 0.295 . . . . 0.0 110.864 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 62.54 -92.4 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.331 -179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.402 ' HA ' ' ND2' ' A' ' 88' ' ' ASN . 1.8 mptm? 61.94 70.91 0.56 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.868 0.366 . . . . 0.0 110.731 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.477 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 19.2 p90 -92.04 -37.52 12.75 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.359 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.94 HG22 ' ND2' ' A' ' 88' ' ' ASN . 5.2 tp -68.12 -10.43 12.71 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 120.705 0.288 . . . . 0.0 111.469 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -77.28 -25.88 51.84 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.842 0.353 . . . . 0.0 110.798 179.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 82.3 p -118.31 -2.35 11.14 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.75 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 59.2 m -110.51 152.71 26.04 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.123 0.487 . . . . 0.0 111.143 -179.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.406 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 1.2 ptm180 -132.87 172.84 12.06 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.606 -179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.408 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.4 p-10 50.13 56.97 7.09 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.951 0.405 . . . . 0.0 112.017 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.683 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.3 p -79.52 132.72 36.4 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.998 178.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.828 ' O ' HD12 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -157.19 163.3 39.0 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.281 -179.515 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.722 HD22 ' O ' ' A' ' 62' ' ' SER . 0.5 OUTLIER -97.56 136.1 38.45 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.789 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.421 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.58 145.65 47.14 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.496 -0.774 . . . . 0.0 109.027 179.176 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.67 -153.4 29.11 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 119.731 -1.224 . . . . 0.0 111.196 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.2 -36.85 19.21 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -178.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.22 35.94 1.9 Allowed 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 112.593 0.59 . . . . 0.0 112.593 -178.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.421 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 15.3 mp0 -116.67 147.66 41.74 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.088 0.471 . . . . 0.0 111.737 179.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.828 HD12 ' O ' ' A' ' 12' ' ' GLN . 13.6 tp -121.75 125.55 46.82 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.536 -0.756 . . . . 0.0 108.988 178.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.04 142.69 47.12 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.867 0.365 . . . . 0.0 110.104 179.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.11 172.17 17.25 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.118 -178.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -114.33 134.77 54.72 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 177.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 59.3 m -130.49 133.32 46.19 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.148 0.499 . . . . 0.0 111.693 -178.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.477 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 1.3 pttt -66.47 136.06 55.15 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.335 -179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.514 HG22 ' O ' ' A' ' 95' ' ' ASP . 46.0 p -84.51 -176.98 6.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.503 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 8.2 mmt180 -62.33 -29.79 70.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.145 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.74 9.78 7.29 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -178.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.0 mt-30 66.77 37.29 4.24 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.144 0.497 . . . . 0.0 111.397 -178.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.477 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 28.2 mt-30 -118.51 137.47 53.18 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.088 178.241 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -94.23 126.5 39.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.898 0.38 . . . . 0.0 111.625 -178.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 25.6 m -131.04 153.0 38.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.051 179.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 23.9 m -73.16 134.11 44.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.12 0.486 . . . . 0.0 111.547 -179.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.0 t -144.59 161.48 39.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.062 179.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.6 ttpt -141.4 156.84 45.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.454 0.645 . . . . 0.0 112.234 -179.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.475 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -136.83 123.76 30.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 114.899 -1.046 . . . . 0.0 108.566 179.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 -86.8 118.75 26.4 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.693 0.282 . . . . 0.0 110.673 -178.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.798 HD11 ' CB ' ' A' ' 19' ' ' LEU . 4.3 mp -86.95 -14.98 40.22 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.902 0.334 . . . . 0.0 111.902 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.491 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.1 p-10 -57.28 -43.73 83.36 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -178.288 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.491 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.1 p30 -91.8 -10.06 41.24 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 122.247 -0.283 . . . . 0.0 111.433 179.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.406 ' CE1' ' CB ' ' A' ' 100' ' ' TYR . 46.7 m-70 -99.84 -64.19 1.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.614 HD11 HD22 ' A' ' 87' ' ' LEU . 26.0 mm -78.64 146.97 7.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.53 178.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.63 ' HB1' ' OG ' ' A' ' 53' ' ' SER . . . -139.56 172.01 13.41 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.611 -179.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.496 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 26.7 t30 -112.74 108.25 17.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.824 -179.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 42.2 mm -109.18 89.54 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.03 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.7 t70 68.3 39.54 2.27 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.138 -179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.3 0.71 90.04 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.903 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 5.8 m -110.61 137.2 48.6 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.845 0.355 . . . . 0.0 110.762 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.491 HD12 ' OG ' ' A' ' 83' ' ' SER . 11.5 mt -77.21 116.78 18.13 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.609 0.718 . . . . 0.0 111.281 -178.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 11.6 mttm -135.49 162.09 33.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 114.56 -1.2 . . . . 0.0 109.805 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.741 ' CE2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -86.21 121.55 28.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.993 0.425 . . . . 0.0 111.476 -179.346 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.452 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 40.5 tt0 -174.17 150.36 1.56 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.38 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.452 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 7.3 Cg_exo -70.42 65.64 2.18 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 122.237 1.958 . . . . 0.0 112.369 -179.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.63 ' OG ' ' HB1' ' A' ' 42' ' ' ALA . 24.6 p -157.45 134.72 10.36 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.394 178.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.436 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -81.36 108.12 14.71 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.422 0.527 . . . . 0.0 112.422 -177.557 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.456 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 40.9 p90 -47.67 -30.69 3.95 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.22 178.267 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.6 p -47.26 -18.4 0.1 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.853 -179.459 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -65.08 -27.06 68.51 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.614 0.245 . . . . 0.0 111.535 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.496 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.5 p -129.22 -1.4 5.11 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.65 -0.25 . . . . 0.0 111.451 179.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.9 m -111.69 149.62 31.34 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.184 0.516 . . . . 0.0 111.916 -178.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -142.19 157.58 44.71 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.735 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 17.4 m120 64.13 48.7 2.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.981 0.419 . . . . 0.0 110.657 -179.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.722 ' O ' HD22 ' A' ' 13' ' ' LEU . 62.8 m -71.37 134.27 46.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.555 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.468 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -141.78 151.84 43.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.561 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.507 HG21 HD13 ' A' ' 19' ' ' LEU . 34.6 mt -130.4 141.52 46.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-O 121.353 0.597 . . . . 0.0 112.185 -179.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -137.74 109.0 6.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.134 -0.939 . . . . 0.0 108.887 178.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.17 -121.83 12.07 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.464 -0.874 . . . . 0.0 111.332 -178.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.42 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 31.2 p -102.47 -2.69 28.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 -179.666 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.482 HG13 ' O ' ' A' ' 85' ' ' ILE . 4.0 t -102.36 139.32 23.7 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.952 0.406 . . . . 0.0 111.592 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.792 HD22 HD22 ' A' ' 37' ' ' LEU . 6.3 tp -102.35 128.2 49.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.628 -179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.62 ' N ' HD12 ' A' ' 69' ' ' LEU . 4.2 m -116.8 123.92 48.29 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.1 t -151.63 153.28 34.15 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.608 0.242 . . . . 0.0 111.21 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.6 m -94.83 126.15 39.96 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.543 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.403 ' HB3' ' OD1' ' A' ' 43' ' ' ASN . 81.4 m -125.59 144.32 50.63 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -178.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -74.52 136.98 42.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.587 178.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 38.6 mtp180 -92.53 142.32 27.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.717 0.294 . . . . 0.0 110.583 179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 5.1 m -52.13 -26.26 10.86 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.619 -179.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -83.18 1.36 40.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.659 0.266 . . . . 0.0 111.532 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.13 133.42 6.53 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.804 179.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.83 -169.02 12.8 Favored Glycine 0 C--N 1.317 -0.483 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 -178.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -132.26 144.03 50.32 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 117.238 0.519 . . . . 0.0 111.413 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -154.11 129.98 10.17 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.558 179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.537 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.4 t -91.82 134.67 34.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.41 -179.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.491 ' OG ' HD12 ' A' ' 48' ' ' LEU . 29.7 p -123.42 158.04 32.06 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.402 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 2.0 m -122.45 145.53 48.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.02 -179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.677 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.9 tt -144.78 143.37 22.74 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.725 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -96.43 116.18 28.64 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.103 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.614 HD22 HD11 ' A' ' 41' ' ' ILE . 11.6 mt -96.95 -6.99 34.28 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -179.117 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.94 ' ND2' HG22 ' A' ' 5' ' ' ILE . 13.2 t-20 -44.86 -28.19 0.62 Allowed 'General case' 0 N--CA 1.466 0.334 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -178.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.4 m -81.98 -38.23 25.46 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.741 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.9 m -74.4 -53.46 17.01 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -178.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.611 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.9 mp -82.2 147.63 5.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 121.06 0.457 . . . . 0.0 111.268 -178.942 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.437 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 9.9 tt0 -137.32 166.54 23.56 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.157 -178.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -107.21 99.42 8.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.121 0.486 . . . . 0.0 110.184 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 33.1 t -98.28 96.08 4.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.196 179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.514 ' O ' HG22 ' A' ' 25' ' ' THR . 28.3 t0 53.09 33.47 15.1 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.655 0.264 . . . . 0.0 111.466 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.59 28.65 12.17 Favored Glycine 0 C--N 1.331 0.288 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.269 179.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 62.5 p -140.92 133.76 29.0 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.802 0.334 . . . . 0.0 110.912 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.437 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 77.4 mt -74.49 121.07 20.93 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.732 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.458 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 8.5 mttm -125.11 137.0 54.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.076 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.406 ' CB ' ' CE1' ' A' ' 40' ' ' HIS . 39.1 t80 -82.78 153.91 25.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.649 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 . . . . . 0 C--O 1.25 1.081 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.789 179.845 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.166 0 N-CA-C 112.444 -0.262 . . . . 0.0 112.444 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 19.0 mt -83.67 174.1 10.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.812 0.339 . . . . 0.0 110.865 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.81 147.44 48.38 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.6 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.4 ptpt -148.95 87.96 1.58 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.829 0.347 . . . . 0.0 110.727 179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.454 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 14.1 p90 -92.97 -40.5 10.53 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.662 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.892 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.0 tp -63.87 -19.33 24.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.633 0.254 . . . . 0.0 111.446 -179.33 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.3 mm-40 -75.45 -26.79 58.57 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.819 0.342 . . . . 0.0 110.855 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.7 p -118.66 13.95 13.43 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.537 179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 71.1 m -127.11 153.6 45.8 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.037 0.446 . . . . 0.0 111.477 -179.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -133.1 172.58 12.46 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.96 179.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.0 p30 49.62 57.66 6.27 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.713 HG21 ' CD1' ' A' ' 5' ' ' ILE . 31.3 p -79.65 134.15 36.42 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.015 178.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.7 ' O ' HD12 ' A' ' 19' ' ' LEU . 17.9 pt20 -158.86 163.84 36.26 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.132 -179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.745 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.39 136.22 38.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.177 0.513 . . . . 0.0 110.991 -179.779 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.74 145.01 46.93 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.381 179.097 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.62 -152.38 30.95 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.899 -1.143 . . . . 0.0 111.55 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -85.89 -37.14 19.45 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -142.11 35.54 1.54 Allowed 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 112.581 0.585 . . . . 0.0 112.581 -179.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.407 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 5.8 mp0 -114.34 146.91 39.93 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.927 0.394 . . . . 0.0 111.48 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.766 ' CB ' HD11 ' A' ' 37' ' ' LEU . 14.0 tp -120.3 124.49 45.72 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 179.183 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.409 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . . . -121.74 144.55 48.73 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 120.94 0.4 . . . . 0.0 110.048 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.79 172.8 15.54 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.089 -178.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -109.78 133.98 52.53 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 176.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.426 ' SG ' HD21 ' A' ' 98' ' ' LEU . 83.0 m -130.67 134.11 46.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.191 0.52 . . . . 0.0 112.139 -178.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.6 ptpt -66.43 137.3 56.76 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.506 -179.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 95' ' ' ASP . 72.8 p -86.06 -179.52 6.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.447 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.9 mmt85 -60.36 -29.87 69.18 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.655 0.264 . . . . 0.0 111.134 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.66 10.39 9.38 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 12.8 mt-30 66.88 39.74 3.29 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.207 0.527 . . . . 0.0 112.052 -179.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.432 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 68.1 mt-30 -119.96 136.03 54.69 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.403 -0.817 . . . . 0.0 108.853 177.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.402 ' CE1' ' HB3' ' A' ' 24' ' ' LYS . 63.7 m-85 -92.09 126.39 37.15 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.023 0.439 . . . . 0.0 111.958 -178.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 29.3 m -131.09 152.49 37.6 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.163 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.3 t -72.96 134.39 44.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.135 0.493 . . . . 0.0 111.667 -179.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 3.3 t -145.76 161.57 39.62 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.362 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.409 ' HG3' ' HB2' ' A' ' 20' ' ' ALA . 20.2 ttpt -144.04 157.17 44.49 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.353 0.597 . . . . 0.0 112.139 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.412 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -135.21 129.4 50.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 115.145 -0.934 . . . . 0.0 108.834 179.498 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -88.52 116.44 26.76 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.558 0.218 . . . . 0.0 111.414 -178.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.806 HD22 HD22 ' A' ' 69' ' ' LEU . 4.2 mp -87.58 -15.91 36.04 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.325 179.572 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.56 -47.28 73.44 Favored 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 -178.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.415 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 3.2 m-20 -92.26 -10.33 38.9 Favored 'General case' 0 N--CA 1.465 0.291 0 O-C-N 122.169 -0.332 . . . . 0.0 111.755 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.434 ' HB3' HD12 ' A' ' 41' ' ' ILE . 21.7 m-70 -96.29 -64.9 1.01 Allowed 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.789 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.63 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.9 mp -82.53 147.71 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.318 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.419 178.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -141.3 171.99 13.3 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.815 -0.629 . . . . 0.0 112.081 -179.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.563 ' C ' HD12 ' A' ' 44' ' ' ILE . 22.6 t30 -112.87 113.21 25.18 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.941 -179.291 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.806 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.5 mp -113.59 89.49 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.937 0.399 . . . . 0.0 111.141 179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 50.1 t0 69.77 37.26 1.88 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.449 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.03 0.75 87.11 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.643 -0.789 . . . . 0.0 113.293 179.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 39.8 m -112.84 135.97 53.0 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 117.198 0.499 . . . . 0.0 110.8 179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.444 HD12 ' OG ' ' A' ' 83' ' ' SER . 18.8 mt -77.18 117.19 18.47 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.635 0.731 . . . . 0.0 111.733 -177.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.806 ' HB2' HD13 ' A' ' 44' ' ' ILE . 30.0 mmtt -137.82 162.86 32.84 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 114.677 -1.147 . . . . 0.0 109.641 179.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.875 ' CH2' HD11 ' A' ' 85' ' ' ILE . 3.6 m-90 -86.51 125.06 33.49 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 121.031 0.443 . . . . 0.0 111.99 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.404 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 12.2 tt0 -175.85 149.09 1.01 Allowed Pre-proline 0 C--N 1.33 -0.262 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.917 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.415 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 7.7 Cg_exo -69.04 66.75 1.34 Allowed 'Trans proline' 0 C--N 1.35 0.654 0 C-N-CA 121.981 1.788 . . . . 0.0 112.061 -179.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -156.81 131.38 8.74 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 114.615 -1.175 . . . . 0.0 108.184 179.096 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -80.68 109.36 15.15 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.258 0.552 . . . . 0.0 112.245 -177.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.446 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 41.1 p90 -48.15 -31.23 5.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.723 178.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.5 p -49.69 -18.28 0.44 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.676 -179.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -62.06 -30.18 70.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.597 0.237 . . . . 0.0 111.013 -179.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.431 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -126.74 -3.39 6.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.289 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.2 m -108.14 148.99 29.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.216 0.532 . . . . 0.0 112.118 -178.594 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.8 p90 -142.96 157.67 44.34 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.053 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 63.36 44.11 5.69 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.007 0.432 . . . . 0.0 110.728 -179.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.745 ' O ' HD22 ' A' ' 13' ' ' LEU . 73.3 m -68.58 136.63 53.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.618 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.417 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.47 152.1 42.38 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.508 -179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.47 HG21 HD13 ' A' ' 19' ' ' LEU . 39.4 mt -129.01 139.68 51.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.238 0.542 . . . . 0.0 111.866 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 37.2 mt-30 -134.12 107.86 7.98 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.44 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.99 -120.19 13.4 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.4 -0.905 . . . . 0.0 111.3 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 24.3 p -99.88 -4.04 31.17 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -179.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.492 HG13 ' O ' ' A' ' 85' ' ' ILE . 12.6 t -103.15 140.09 22.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 112.411 0.523 . . . . 0.0 112.411 -179.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.806 HD22 HD22 ' A' ' 37' ' ' LEU . 8.5 tp -103.16 125.57 49.92 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.573 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.454 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.1 m -115.3 125.74 53.64 Favored 'General case' 0 N--CA 1.461 0.108 0 N-CA-C 110.094 -0.335 . . . . 0.0 110.094 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.3 t -151.86 153.59 34.5 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.69 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 10.7 m -95.53 126.12 40.59 Favored 'General case' 0 C--O 1.231 0.111 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 178.453 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 70.8 m -127.45 146.7 50.4 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.64 0.608 . . . . 0.0 112.64 -178.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -75.27 137.1 40.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.266 -0.879 . . . . 0.0 111.108 178.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 30.5 mtm180 -91.98 143.98 25.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.19 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 14.2 m -51.83 -27.17 11.64 Favored 'General case' 0 N--CA 1.463 0.188 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -179.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -82.39 1.81 35.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.694 0.283 . . . . 0.0 111.436 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.92 136.04 7.54 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.869 -0.681 . . . . 0.0 112.817 179.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.18 -166.85 12.23 Favored Glycine 0 C--N 1.319 -0.362 0 N-CA-C 111.658 -0.577 . . . . 0.0 111.658 -179.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -133.32 143.09 48.79 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.979 0.419 . . . . 0.0 111.163 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -154.3 132.95 12.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.119 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.3 t -94.22 134.38 36.74 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.842 0.353 . . . . 0.0 111.656 -179.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.444 ' OG ' HD12 ' A' ' 48' ' ' LEU . 23.5 p -119.8 157.76 27.96 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.192 179.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 16.7 m -121.44 142.38 50.08 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.916 0.389 . . . . 0.0 111.088 -179.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.875 HD11 ' CH2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -147.78 144.51 19.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.613 -179.927 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.753 ' N ' HD13 ' A' ' 85' ' ' ILE . 15.0 t0 -101.05 121.33 41.61 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.285 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.733 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 2.3 mt -100.66 -3.22 30.77 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -179.405 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.892 ' ND2' HG22 ' A' ' 5' ' ' ILE . 5.3 t-20 -45.3 -26.92 0.58 Allowed 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -178.706 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.91 -42.12 24.77 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -179.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.666 HG11 ' CE2' ' A' ' 50' ' ' TRP . 4.1 m -72.63 -51.32 28.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 -177.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.513 ' N ' HG23 ' A' ' 90' ' ' VAL . 2.7 mp -81.78 147.3 6.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.037 0.446 . . . . 0.0 111.347 -179.006 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.404 ' N ' ' O ' ' A' ' 99' ' ' LYS . 3.9 tt0 -138.62 166.8 23.42 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.972 -178.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -107.69 99.93 9.37 Favored 'General case' 0 C--O 1.231 0.107 0 CA-C-O 121.191 0.52 . . . . 0.0 110.855 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.3 t -98.89 97.14 5.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.13 179.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.476 ' O ' HG22 ' A' ' 25' ' ' THR . 25.8 t0 53.79 33.13 16.24 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.7 28.4 12.53 Favored Glycine 0 CA--C 1.518 0.271 0 C-N-CA 120.585 -0.817 . . . . 0.0 113.206 179.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.9 m -141.41 135.48 30.43 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.867 0.365 . . . . 0.0 111.318 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.426 HD21 ' SG ' ' A' ' 23' ' ' CYS . 28.1 mt -74.39 119.4 18.53 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.44 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.404 ' O ' ' N ' ' A' ' 92' ' ' GLU . 0.3 OUTLIER -125.31 135.64 52.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 112.321 179.911 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.417 ' CD1' ' N ' ' A' ' 101' ' ' GLU . 8.5 t80 -82.27 146.26 29.56 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.678 178.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.417 ' N ' ' CD1' ' A' ' 100' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.239 -0.886 . . . . 0.0 111.083 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 N-CA-C 112.786 -0.125 . . . . 0.0 112.786 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.474 ' C ' HD12 ' A' ' 1' ' ' LEU . 2.2 pp -175.37 172.56 2.67 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.586 0.231 . . . . 0.0 110.746 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 89.33 -110.1 3.67 Favored Glycine 0 CA--C 1.521 0.417 0 C-N-CA 120.563 -0.827 . . . . 0.0 112.214 -179.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.8 mmtp 62.16 64.84 0.93 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.767 0.318 . . . . 0.0 111.051 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 24.1 p90 -92.0 -41.72 10.39 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.733 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.949 HG22 ' ND2' ' A' ' 88' ' ' ASN . 4.4 tp -62.48 -21.11 26.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.389 -179.797 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -72.15 -24.28 61.42 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.744 0.307 . . . . 0.0 110.598 179.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 30.6 p -119.09 -3.99 10.6 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 179.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 86.3 m -107.19 152.07 24.56 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-O 120.811 0.339 . . . . 0.0 111.188 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -131.65 173.25 11.32 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.719 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 47.1 57.73 5.46 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.78 HG21 ' CD1' ' A' ' 5' ' ' ILE . 82.1 p -78.82 132.46 36.87 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.872 178.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.716 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.0 pt20 -158.57 164.34 36.17 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.959 0.409 . . . . 0.0 111.667 -179.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.645 HD22 ' O ' ' A' ' 62' ' ' SER . 0.9 OUTLIER -97.5 135.8 38.83 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.497 -179.315 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -119.13 145.1 46.25 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.257 178.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 56.64 -150.27 27.16 Favored Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.318 -0.944 . . . . 0.0 111.425 -178.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.35 -37.82 18.08 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 112.789 0.662 . . . . 0.0 112.789 -178.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.449 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.9 p -141.17 37.1 1.73 Allowed 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 113.16 0.8 . . . . 0.0 113.16 -178.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -114.66 148.75 37.74 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.943 0.401 . . . . 0.0 111.869 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.813 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.1 tp -121.89 122.35 39.21 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.191 179.198 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.73 143.43 46.22 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 179.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.38 172.68 16.13 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.951 -178.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -113.63 133.36 55.34 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 177.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.555 ' SG ' HD21 ' A' ' 98' ' ' LEU . 54.7 m -130.47 132.78 45.85 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.148 0.499 . . . . 0.0 111.519 -178.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.4 ptpt -64.84 137.95 58.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.671 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.403 HG22 ' O ' ' A' ' 95' ' ' ASP . 52.6 p -86.6 -177.42 6.15 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.771 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.8 mtp85 -61.48 -29.36 69.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.455 -0.338 . . . . 0.0 111.028 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.43 8.84 12.59 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.09 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 67.04 36.83 4.02 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.163 0.506 . . . . 0.0 111.274 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 62.2 mm-40 -117.07 134.53 54.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -90.99 124.92 35.6 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.119 0.485 . . . . 0.0 111.817 -178.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.6 m -130.16 150.86 35.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.635 179.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.7 t -72.03 136.57 46.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.345 0.593 . . . . 0.0 111.776 -178.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.7 t -145.34 162.35 37.44 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.212 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.414 ' HG2' ' N ' ' A' ' 35' ' ' ILE . 0.9 OUTLIER -144.7 156.1 43.91 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.537 0.685 . . . . 0.0 111.92 -179.172 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.513 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -135.38 126.8 45.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.633 179.173 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -87.58 114.65 24.39 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.703 0.287 . . . . 0.0 110.807 -178.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.891 HD22 HD22 ' A' ' 69' ' ' LEU . 3.6 mp -86.15 -15.51 40.84 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.952 179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.85 -46.04 78.29 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 120.631 -0.428 . . . . 0.0 111.591 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -91.55 -10.2 41.49 Favored 'General case' 0 N--CA 1.466 0.335 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.45 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 30.3 m-70 -96.61 -60.34 1.63 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.525 HD13 ' CD1' ' A' ' 50' ' ' TRP . 32.8 mm -81.03 146.75 6.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.571 178.767 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.409 ' HA ' ' O ' ' A' ' 53' ' ' SER . . . -139.56 170.14 16.45 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.395 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.43 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 34.7 t30 -111.92 108.69 18.13 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.86 -179.249 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.453 HD11 HE21 ' A' ' 51' ' ' GLN . 48.2 mm -108.51 88.76 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.791 179.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 53.8 t0 66.43 39.42 3.94 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 120.827 0.346 . . . . 0.0 111.563 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.78 0.38 89.79 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 121.007 -0.616 . . . . 0.0 113.404 179.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 7.0 m -109.02 136.33 48.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 117.009 0.405 . . . . 0.0 110.958 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.479 HD22 HG21 ' A' ' 41' ' ' ILE . 12.6 mt -77.57 117.03 18.61 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.519 0.676 . . . . 0.0 111.408 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 18.7 mmtt -138.39 163.51 31.7 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.849 -1.069 . . . . 0.0 109.607 179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.795 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 7.4 m-90 -84.77 124.27 31.37 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.811 -0.355 . . . . 0.0 110.976 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.453 HE21 HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -173.05 146.78 1.43 Allowed Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.848 -178.625 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -70.56 65.62 2.26 Favored 'Trans proline' 0 C--N 1.358 1.044 0 C-N-CA 122.464 2.11 . . . . 0.0 111.571 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.409 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.1 p -159.62 132.11 6.61 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.467 -1.242 . . . . 0.0 107.998 179.539 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.57 109.69 15.34 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -177.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.449 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.0 p90 -48.64 -30.31 5.3 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.974 177.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 35.4 p -49.92 -18.76 0.56 Allowed 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -63.1 -26.43 68.83 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.973 -0.291 . . . . 0.0 110.818 -179.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.43 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 3.9 p -129.76 0.72 4.88 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.302 178.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 5.5 m -111.84 148.16 34.21 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 121.321 0.582 . . . . 0.0 112.268 -178.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 35.5 p90 -141.7 157.99 44.37 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.528 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 54.4 m-20 64.3 42.56 5.25 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.838 0.351 . . . . 0.0 110.959 -179.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.645 ' O ' HD22 ' A' ' 13' ' ' LEU . 55.0 m -68.57 137.88 54.66 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.498 179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -143.84 150.99 39.32 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.878 -179.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.48 HG13 ' HB2' ' A' ' 13' ' ' LEU . 21.4 mt -129.09 140.24 49.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 121.47 0.652 . . . . 0.0 112.34 -179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -137.84 108.85 6.74 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.913 -1.04 . . . . 0.0 109.036 179.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.413 ' C ' HD13 ' A' ' 5' ' ' ILE . . . 69.59 -122.64 12.44 Favored Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.322 -0.942 . . . . 0.0 111.145 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.405 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 24.6 p -100.91 -5.46 26.0 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.304 0.483 . . . . 0.0 112.304 -179.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.491 HG13 ' O ' ' A' ' 85' ' ' ILE . 3.2 t -101.1 140.77 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 120.995 0.426 . . . . 0.0 111.845 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.891 HD22 HD22 ' A' ' 37' ' ' LEU . 9.0 tp -104.28 127.61 51.94 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.655 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.469 ' N ' HD12 ' A' ' 69' ' ' LEU . 6.0 m -116.28 123.81 48.61 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.865 -179.728 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.3 t -151.47 153.28 34.33 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 121.242 -0.183 . . . . 0.0 111.304 -178.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.5 m -95.45 126.11 40.52 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 178.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 72.7 m -125.8 145.16 50.34 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -178.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -75.78 136.84 40.26 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 115.201 -0.909 . . . . 0.0 110.598 178.375 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 45.3 mtm180 -91.78 146.19 23.96 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.634 0.254 . . . . 0.0 110.693 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.4 m -52.25 -30.39 27.47 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -179.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -82.26 1.52 36.33 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.481 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.43 137.04 6.75 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.481 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 118.45 -176.43 16.11 Favored Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 110.37 -1.092 . . . . 0.0 110.37 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 20.7 m-85 -127.73 141.58 51.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 117.576 0.688 . . . . 0.0 110.903 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -153.84 128.8 9.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.015 0.436 . . . . 0.0 110.665 -179.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -92.18 135.48 33.96 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.894 -179.325 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 50.3 p -122.46 158.22 30.24 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.102 179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 58.2 m -124.95 146.26 49.46 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.882 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.795 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 12.2 tt -146.34 143.69 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.769 -179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -95.41 119.72 34.39 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.386 179.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.562 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 7.1 mt -100.23 -5.81 27.0 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.949 ' ND2' HG22 ' A' ' 5' ' ' ILE . 11.1 t-20 -44.5 -29.1 0.66 Allowed 'General case' 0 N--CA 1.47 0.527 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -178.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.13 -38.37 27.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.799 0.666 . . . . 0.0 112.799 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.726 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -74.42 -52.43 19.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 N-CA-C 113.83 1.048 . . . . 0.0 113.83 -178.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.608 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.6 mp -82.81 146.37 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-O 120.859 0.362 . . . . 0.0 111.866 -178.689 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.405 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 21.4 tt0 -135.75 164.04 28.8 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.223 -178.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.7 t30 -107.05 99.75 9.28 Favored 'General case' 0 C--O 1.231 0.121 0 CA-C-O 121.38 0.61 . . . . 0.0 111.019 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 52.4 t -97.02 97.07 5.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.142 -0.936 . . . . 0.0 110.867 179.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.403 ' O ' HG22 ' A' ' 25' ' ' THR . 15.1 t0 51.65 33.3 10.57 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 179.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 95.03 28.75 9.63 Favored Glycine 0 C--N 1.329 0.168 0 C-N-CA 120.444 -0.884 . . . . 0.0 113.104 178.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 69.8 m -142.07 135.21 28.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.89 0.376 . . . . 0.0 111.035 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.555 HD21 ' SG ' ' A' ' 23' ' ' CYS . 44.5 mt -75.11 121.89 22.75 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.192 -179.483 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 6.1 mttm -126.59 134.35 50.83 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.118 0.485 . . . . 0.0 112.178 -179.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.45 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 10.1 t80 -87.16 114.58 23.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.43 179.333 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.944 -179.694 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.066 0 N-CA-C 112.596 -0.202 . . . . 0.0 112.596 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 8.2 mt -98.31 -74.97 0.56 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.691 0.281 . . . . 0.0 110.8 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -70.06 160.95 53.26 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.948 -0.644 . . . . 0.0 112.78 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.6 mttt -155.31 83.4 1.06 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.52 0.2 . . . . 0.0 110.908 179.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.434 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 16.0 p90 -93.5 -41.07 9.98 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.928 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.2 tp -61.41 -20.73 23.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -74.12 -25.28 59.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.311 179.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.5 p -118.75 -5.95 10.63 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.667 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 66.3 m -104.91 152.77 22.24 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.08 0.467 . . . . 0.0 111.122 -179.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -132.18 172.86 11.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.963 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.2 p-10 47.33 58.33 4.98 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.015 0.436 . . . . 0.0 111.721 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.781 HG21 ' CD1' ' A' ' 5' ' ' ILE . 54.4 p -79.11 130.27 35.33 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.664 178.639 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.649 ' O ' HD12 ' A' ' 19' ' ' LEU . 18.0 pt20 -156.67 164.13 38.51 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.778 -178.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.7 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.45 136.89 37.23 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.918 -179.902 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -120.82 144.23 48.45 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 178.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 60.27 -152.63 36.95 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 119.818 -1.182 . . . . 0.0 111.589 -179.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.7 m -86.64 -36.32 18.85 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -178.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.43 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 2.9 p -142.65 34.67 1.43 Allowed 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.291 0.848 . . . . 0.0 113.291 -178.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -113.51 151.22 31.82 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.957 0.408 . . . . 0.0 112.081 178.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.825 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.4 tp -124.85 124.88 43.02 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 179.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.411 ' HB2' ' HG3' ' A' ' 34' ' ' LYS . . . -120.55 143.34 48.65 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.69 172.74 15.74 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.176 -178.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -114.43 133.94 55.36 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 32.3 m -130.74 132.98 45.64 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.114 0.483 . . . . 0.0 111.877 -179.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 10.6 ptpt -65.74 137.83 57.53 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.435 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 95' ' ' ASP . 54.7 p -85.16 -176.31 6.11 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.575 179.868 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -62.34 -30.12 70.95 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.915 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.51 9.02 10.1 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -179.201 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 5.5 mm100 66.95 37.9 3.77 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.035 0.445 . . . . 0.0 111.806 -178.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.402 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 9.2 mt-30 -118.77 135.66 54.39 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 177.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 52.0 m-85 -90.6 124.98 35.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.921 0.391 . . . . 0.0 111.995 -178.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.9 m -129.79 148.54 33.21 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.755 179.398 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.3 m -70.25 135.1 48.67 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.22 0.533 . . . . 0.0 111.959 -178.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -144.62 161.81 38.22 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.344 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.411 ' HG3' ' HB2' ' A' ' 20' ' ' ALA . 28.7 ttpt -142.92 157.43 44.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.531 0.682 . . . . 0.0 112.333 -179.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.448 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.9 OUTLIER -137.12 126.84 37.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.039 179.826 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -88.47 115.0 25.67 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.886 0.374 . . . . 0.0 111.535 -178.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.825 HD11 ' CB ' ' A' ' 19' ' ' LEU . 2.8 mp -85.66 -16.42 39.18 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.543 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.403 ' OD1' ' N ' ' A' ' 38' ' ' ASP . 0.0 OUTLIER -55.84 -48.15 75.99 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 120.637 0.256 . . . . 0.0 111.214 -179.047 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.403 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.2 OUTLIER -91.47 -10.43 40.89 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 120.736 -0.386 . . . . 0.0 111.594 179.515 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -95.05 -66.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 179.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.818 HD12 HD23 ' A' ' 37' ' ' LEU . 45.3 mt -79.85 151.19 4.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.747 178.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -141.35 172.28 12.91 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.029 -179.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.417 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 37.1 t30 -109.2 109.68 20.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.809 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 44.7 mm -110.7 88.93 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.637 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.7 t70 68.15 39.84 2.31 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.604 179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.15 1.14 90.52 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 120.625 -0.798 . . . . 0.0 113.094 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 9.3 m -112.54 137.05 51.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.88 0.371 . . . . 0.0 110.953 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 52.1 mt -76.66 116.07 17.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.548 0.69 . . . . 0.0 110.58 -178.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -135.18 161.96 33.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.609 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.74 ' CE2' HG11 ' A' ' 90' ' ' VAL . 6.1 m-90 -87.78 120.89 29.56 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.991 0.424 . . . . 0.0 111.512 -179.496 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.435 ' HG3' ' HD2' ' A' ' 52' ' ' PRO . 20.2 tt0 -175.25 143.73 0.76 Allowed Pre-proline 0 N--CA 1.465 0.28 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.823 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.435 ' HD2' ' HG3' ' A' ' 51' ' ' GLN . 33.6 Cg_endo -64.25 75.71 0.18 Allowed 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 121.983 1.789 . . . . 0.0 112.91 -179.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 p -165.68 133.5 2.98 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 114.842 -1.072 . . . . 0.0 108.332 179.126 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.07 110.0 16.17 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.231 0.539 . . . . 0.0 112.151 -178.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.2 p90 -49.58 -29.16 6.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.573 178.451 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 61.5 p -49.6 -17.7 0.35 Allowed 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.149 0.796 . . . . 0.0 113.149 -179.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -62.51 -28.14 69.64 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 120.595 0.235 . . . . 0.0 111.216 -179.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.417 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.4 p -129.84 -1.25 4.76 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 179.682 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 6.9 m -109.49 147.62 32.59 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.332 0.587 . . . . 0.0 112.482 -178.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 10.0 p90 -142.92 158.52 43.54 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.605 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 64.31 43.53 4.71 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.858 -179.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.7 ' O ' HD22 ' A' ' 13' ' ' LEU . 74.3 m -68.64 137.06 53.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.931 179.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.436 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -144.0 152.93 41.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.291 179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.498 ' CG1' HD13 ' A' ' 69' ' ' LEU . 43.5 mt -130.47 140.87 47.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.254 0.549 . . . . 0.0 111.717 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -137.17 107.96 6.63 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.262 -0.881 . . . . 0.0 108.668 179.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.71 -122.29 11.84 Favored Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.615 -0.802 . . . . 0.0 111.631 -178.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 21.5 p -101.08 -5.33 25.87 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.47 HG13 ' O ' ' A' ' 85' ' ' ILE . 10.6 t -101.41 139.56 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.33 0 CA-C-O 120.882 0.372 . . . . 0.0 111.672 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.759 HD22 HD22 ' A' ' 37' ' ' LEU . 9.8 tp -101.67 127.73 48.29 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.675 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.477 ' N ' HD12 ' A' ' 69' ' ' LEU . 7.2 m -116.75 123.12 46.39 Favored 'General case' 0 N--CA 1.461 0.099 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.1 t -151.96 153.99 35.17 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.748 -178.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.5 m -94.34 125.66 39.12 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 178.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 88.4 m -125.61 142.87 51.28 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.228 0.537 . . . . 0.0 112.445 -178.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -74.46 138.5 43.29 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.728 178.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.5 mtp180 -91.43 144.56 25.45 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.629 0.252 . . . . 0.0 110.629 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 24.6 m -52.62 -27.65 17.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.326 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -82.16 2.45 31.45 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.678 0.275 . . . . 0.0 111.208 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 90.78 136.46 6.7 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.726 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 115.59 -170.24 13.22 Favored Glycine 0 N--CA 1.448 -0.509 0 N-CA-C 111.245 -0.742 . . . . 0.0 111.245 -178.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 28.2 m-85 -130.73 142.36 50.41 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 117.23 0.515 . . . . 0.0 111.226 -179.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -154.0 130.15 10.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.459 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.46 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.4 t -93.39 134.9 35.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.037 0.446 . . . . 0.0 111.743 -179.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 89.7 p -122.22 158.49 29.33 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.344 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 71.4 m -122.76 146.05 47.86 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.823 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.725 HD11 ' CH2' ' A' ' 50' ' ' TRP . 9.7 tt -147.76 143.46 19.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.037 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -97.07 119.82 36.27 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.684 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.535 ' HB3' HD12 ' A' ' 91' ' ' ILE . 9.4 mt -100.71 -6.41 25.08 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.23 0.826 . . . . 0.0 113.23 -178.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.928 ' ND2' HG22 ' A' ' 5' ' ' ILE . 6.2 t-20 -45.09 -29.72 0.95 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -178.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 3.3 t -81.28 -39.45 25.21 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.74 HG11 ' CE2' ' A' ' 50' ' ' TRP . 2.8 m -72.68 -52.1 24.74 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.349 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -178.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.632 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.85 147.33 6.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 121.054 0.454 . . . . 0.0 110.764 179.881 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -138.49 165.94 25.55 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.097 -178.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 29.0 t30 -106.59 99.7 9.26 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 121.221 0.534 . . . . 0.0 110.27 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 41.1 t -98.54 95.32 4.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.885 179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.48 ' O ' HG22 ' A' ' 25' ' ' THR . 33.9 t0 52.13 32.61 10.76 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.573 0.225 . . . . 0.0 111.58 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 94.78 28.56 10.05 Favored Glycine 0 C--N 1.329 0.155 0 C-N-CA 120.593 -0.813 . . . . 0.0 113.635 178.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 4.1 m -141.65 134.33 28.52 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.932 0.366 . . . . 0.0 110.632 179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.425 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 82.6 mt -73.26 120.6 19.09 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.678 -179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.407 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 11.7 mttt -125.91 141.07 52.14 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.136 0.493 . . . . 0.0 112.276 -178.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -80.85 76.04 7.79 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.31 179.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.173 -0.918 . . . . 0.0 111.06 -179.566 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.187 0 N-CA-C 112.45 -0.26 . . . . 0.0 112.45 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 1' ' ' LEU . 4.3 mm? -64.39 -178.31 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.748 0.309 . . . . 0.0 110.804 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -137.65 -58.06 0.05 OUTLIER Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.428 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.9 mttt 60.25 71.15 0.58 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.865 0.364 . . . . 0.0 110.844 -179.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.44 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 18.5 p90 -92.89 -39.33 11.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.789 -179.644 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.921 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.0 tp -63.4 -18.16 21.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.728 0.299 . . . . 0.0 111.495 -179.655 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -74.8 -24.31 58.63 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.978 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 27.1 p -118.71 15.1 13.57 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.649 179.598 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 56.5 m -131.47 154.09 49.08 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.171 0.51 . . . . 0.0 111.304 -179.655 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.4 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 6.3 ptt180 -132.76 173.19 11.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.676 -179.906 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.419 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.7 p-10 48.95 56.71 7.34 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -179.998 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.648 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.0 p -79.37 133.75 36.59 Favored 'General case' 0 C--N 1.332 -0.168 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 178.565 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.677 ' O ' HD12 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -158.09 164.21 36.88 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.845 -178.911 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.714 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.41 136.35 37.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.994 -179.859 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.5 144.62 46.91 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-N 115.454 -0.794 . . . . 0.0 108.993 178.977 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.15 -152.16 29.45 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 119.847 -1.168 . . . . 0.0 111.846 -179.09 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.73 -36.7 20.01 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -178.343 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -142.53 35.92 1.47 Allowed 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 -178.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.8 mp0 -114.5 147.53 39.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.199 0.523 . . . . 0.0 111.689 179.09 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.768 ' CB ' HD11 ' A' ' 37' ' ' LEU . 17.3 tp -120.93 123.99 43.84 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.394 179.287 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.572 ' HB2' ' HE2' ' A' ' 34' ' ' LYS . . . -121.42 142.98 49.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 120.961 0.41 . . . . 0.0 110.105 179.712 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.59 172.64 16.0 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.945 -178.788 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -111.82 133.73 53.84 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 176.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.3 m -130.61 133.95 46.59 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.072 0.463 . . . . 0.0 111.66 -178.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 8.1 ptpt -67.11 137.49 56.39 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.704 -179.479 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.511 HG22 ' O ' ' A' ' 95' ' ' ASP . 72.1 p -85.59 -179.19 6.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.402 179.772 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -60.63 -29.77 69.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.659 0.266 . . . . 0.0 111.12 -179.54 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.58 9.36 9.56 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -178.948 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 67.04 38.52 3.46 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.146 0.498 . . . . 0.0 111.911 -179.014 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.402 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 12.6 mm100 -119.53 134.95 54.99 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.515 -0.766 . . . . 0.0 108.968 178.06 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -92.25 124.94 36.69 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.025 0.44 . . . . 0.0 111.821 -178.62 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.2 m -129.87 150.46 34.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.735 179.667 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 11.8 p -71.25 134.4 46.81 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.239 0.542 . . . . 0.0 111.725 -178.737 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.3 t -142.74 161.86 36.97 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.295 -179.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.572 ' HE2' ' HB2' ' A' ' 20' ' ' ALA . 17.6 ttmt -143.67 156.18 44.47 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.481 0.658 . . . . 0.0 112.187 -179.07 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.588 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -136.53 124.94 35.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 114.998 -1.001 . . . . 0.0 108.501 179.142 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 25.1 t-20 -88.24 119.02 28.24 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.709 0.29 . . . . 0.0 111.294 -177.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.829 HD22 HD22 ' A' ' 69' ' ' LEU . 4.0 mp -89.04 -14.72 35.78 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.808 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 2.0 p-10 -57.87 -43.44 85.99 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.754 -178.467 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.423 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 0.5 OUTLIER -92.77 -10.52 36.64 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.944 -0.472 . . . . 0.0 111.611 178.691 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.463 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 26.6 m-70 -97.98 -64.2 1.06 Allowed 'General case' 0 C--O 1.232 0.16 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.668 HD11 HD22 ' A' ' 87' ' ' LEU . 31.5 mm -80.07 145.73 8.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.444 178.764 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.457 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -137.92 171.46 14.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.5 -179.811 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.549 ' C ' HD12 ' A' ' 44' ' ' ILE . 20.2 t30 -113.12 111.71 22.58 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.439 -0.801 . . . . 0.0 111.251 -178.968 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.761 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.2 mp -112.7 95.03 3.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.394 179.192 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 34.3 t0 64.12 38.06 8.6 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.078 -179.561 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.08 11.63 82.17 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.64 -0.79 . . . . 0.0 113.218 179.374 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.7 m -120.4 136.49 54.71 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 117.024 0.412 . . . . 0.0 110.721 179.649 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.59 HD22 HG21 ' A' ' 41' ' ' ILE . 25.6 mt -77.42 118.1 19.54 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.559 0.695 . . . . 0.0 111.624 -177.976 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.761 ' HB2' HD13 ' A' ' 44' ' ' ILE . 25.6 mttt -139.15 163.42 32.47 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 114.687 -1.142 . . . . 0.0 110.006 -179.916 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.822 ' CH2' HD11 ' A' ' 85' ' ' ILE . 4.8 m-90 -85.4 119.0 25.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.956 0.408 . . . . 0.0 111.78 -179.413 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.457 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 18.0 mt-30 -169.4 151.45 4.51 Favored Pre-proline 0 N--CA 1.468 0.425 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.5 179.777 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.75 60.82 2.91 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 121.975 1.783 . . . . 0.0 112.394 -179.744 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 42' ' ' ALA . 3.7 p -153.43 135.75 14.96 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.442 -0.799 . . . . 0.0 108.89 179.123 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 15.8 p-10 -81.03 113.06 18.98 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -177.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.424 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 48.5 p90 -52.57 -33.49 46.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.451 -0.795 . . . . 0.0 110.414 178.316 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 60.1 p -48.97 -21.29 0.64 Allowed 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.702 -179.11 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.8 mm-40 -62.0 -25.26 67.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.62 0.248 . . . . 0.0 110.898 -179.278 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.418 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.1 p -127.71 -2.24 6.03 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.565 -0.289 . . . . 0.0 111.127 178.797 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.8 m -111.09 148.36 32.83 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.25 0.548 . . . . 0.0 112.369 -178.277 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 41.3 p90 -140.12 157.33 45.8 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.053 179.538 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 41.1 m-20 62.99 45.15 5.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.059 0.457 . . . . 0.0 110.444 -178.989 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.714 ' O ' HD22 ' A' ' 13' ' ' LEU . 67.3 m -70.04 136.54 50.44 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.658 179.854 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.44 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -143.57 154.0 43.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.134 -179.618 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.522 HD13 HD13 ' A' ' 19' ' ' LEU . 47.0 mt -130.8 140.12 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.59 179.526 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -134.76 108.68 8.1 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.159 -0.928 . . . . 0.0 108.549 178.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.9 -119.68 11.26 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.327 -0.939 . . . . 0.0 111.193 -178.203 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.417 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 26.7 p -102.83 -3.49 26.24 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.411 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.53 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.3 t -101.55 137.58 28.76 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 120.93 0.395 . . . . 0.0 111.844 -179.835 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.829 HD22 HD22 ' A' ' 37' ' ' LEU . 9.3 tp -101.03 124.79 47.29 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.781 179.536 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.4 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.6 m -114.87 126.77 55.19 Favored 'General case' 0 CA--C 1.521 -0.144 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.349 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.9 t -151.68 153.62 34.74 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.73 0.3 . . . . 0.0 111.282 -179.127 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 5.6 m -94.3 125.61 39.04 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 178.703 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 85.9 m -128.55 147.2 50.69 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.787 0.662 . . . . 0.0 112.787 -178.44 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -75.48 136.79 40.64 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.179 178.505 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 50.7 mtp180 -91.7 144.05 25.92 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 110.248 -0.278 . . . . 0.0 110.248 179.282 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 8.3 m -52.19 -28.58 18.79 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.053 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -80.8 2.2 27.33 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.676 0.274 . . . . 0.0 111.504 -179.855 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.03 135.06 6.7 Favored Glycine 0 N--CA 1.448 -0.567 0 C-N-CA 120.89 -0.672 . . . . 0.0 112.561 179.99 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.5 -168.72 12.99 Favored Glycine 0 C--N 1.318 -0.442 0 N-CA-C 111.612 -0.595 . . . . 0.0 111.612 -179.0 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -131.2 141.14 50.01 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.877 0.339 . . . . 0.0 110.992 -179.615 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 3.6 t30 -154.6 132.66 11.68 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.653 -179.906 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.488 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -94.44 134.55 36.84 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.784 -179.367 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.5 p -121.46 157.99 29.38 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 120.897 0.38 . . . . 0.0 110.63 179.696 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 8.1 p -120.76 143.92 48.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.328 -179.511 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.822 HD11 ' CH2' ' A' ' 50' ' ' TRP . 0.0 OUTLIER -146.83 145.5 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.333 179.563 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.777 ' N ' HD13 ' A' ' 85' ' ' ILE . 21.0 t0 -101.5 121.54 42.15 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.422 -179.479 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.668 HD22 HD11 ' A' ' 41' ' ' ILE . 4.3 mt -103.46 -2.88 26.16 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.579 0.955 . . . . 0.0 113.579 -178.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.921 ' ND2' HG22 ' A' ' 5' ' ' ILE . 13.0 t-20 -44.87 -27.31 0.51 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.388 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 1.4 m -81.37 -39.13 25.49 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.64 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.644 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.7 m -75.3 -52.45 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 113.823 1.046 . . . . 0.0 113.823 -177.668 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.506 ' N ' HG23 ' A' ' 90' ' ' VAL . 2.6 mp -80.52 145.57 8.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 120.895 0.378 . . . . 0.0 110.969 -179.148 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -136.84 165.97 24.71 Favored 'General case' 0 C--N 1.333 -0.122 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.343 -178.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -105.9 99.28 8.88 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.116 0.484 . . . . 0.0 110.34 179.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.505 HG11 ' HE3' ' A' ' 99' ' ' LYS . 38.2 t -98.59 95.49 4.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.108 179.564 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.511 ' O ' HG22 ' A' ' 25' ' ' THR . 24.7 t0 55.35 31.88 17.65 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.626 0.251 . . . . 0.0 111.559 179.746 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.07 28.21 12.29 Favored Glycine 0 C--N 1.329 0.158 0 C-N-CA 120.745 -0.74 . . . . 0.0 113.156 179.479 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 74.0 m -140.3 135.09 31.88 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.757 0.313 . . . . 0.0 110.801 179.776 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 66.6 mt -73.48 121.19 20.16 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.085 -179.652 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.505 ' HE3' HG11 ' A' ' 94' ' ' VAL . 17.0 mttt -124.78 126.3 45.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.07 0.462 . . . . 0.0 111.572 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.463 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 56.0 t80 -77.14 149.81 35.61 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.637 179.837 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.799 -179.81 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.189 0 N-CA-C 112.499 -0.24 . . . . 0.0 112.499 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.522 ' O ' HD23 ' A' ' 1' ' ' LEU . 2.7 tt -172.34 -47.97 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.715 0.293 . . . . 0.0 111.044 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -169.04 -110.71 0.23 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.71 -179.94 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 38.8 mttt 63.41 64.42 0.82 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.001 0.429 . . . . 0.0 110.554 -179.809 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.475 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 17.5 p90 -91.02 -39.19 12.34 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.584 -179.602 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.946 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.2 tp -65.45 -14.68 17.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 CA-C-O 120.68 0.276 . . . . 0.0 111.631 -179.447 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -74.91 -24.64 58.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.819 0.342 . . . . 0.0 110.717 179.424 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.4 p -118.65 -2.77 10.91 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.495 179.31 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 68.0 m -108.88 150.3 27.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.084 0.469 . . . . 0.0 111.236 -179.526 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.429 ' O ' ' OD1' ' A' ' 10' ' ' ASN . 4.4 ptm180 -132.18 172.52 12.31 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.779 -179.861 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.429 ' OD1' ' O ' ' A' ' 9' ' ' ARG . 5.7 p-10 48.71 58.26 5.47 Favored 'General case' 0 C--N 1.332 -0.161 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -179.908 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.714 HG21 ' CD1' ' A' ' 5' ' ' ILE . 42.6 p -79.25 132.15 36.39 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.75 178.65 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.707 ' O ' HD12 ' A' ' 19' ' ' LEU . 13.4 pt20 -156.13 163.28 39.82 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.253 -179.228 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.752 HD22 ' O ' ' A' ' 62' ' ' SER . 0.8 OUTLIER -97.65 135.7 39.09 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.903 -179.754 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.453 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.54 144.31 48.13 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 179.12 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.07 -153.07 31.45 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 119.764 -1.208 . . . . 0.0 111.321 -178.761 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.55 -37.24 19.83 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.794 0.664 . . . . 0.0 112.794 -178.243 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.461 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.92 36.67 1.59 Allowed 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -179.201 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 1.1 mp0 -114.09 144.29 43.39 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.968 0.413 . . . . 0.0 111.317 178.617 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.799 ' CB ' HD11 ' A' ' 37' ' ' LEU . 13.4 tp -117.33 123.83 47.47 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.672 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.38 142.17 47.44 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.899 -0.408 . . . . 0.0 109.899 179.445 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.01 172.22 17.27 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.152 -178.591 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 16.2 mt-10 -116.06 133.58 55.87 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.751 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 32.1 m -130.73 134.52 46.97 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.131 0.491 . . . . 0.0 111.573 -179.104 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 4.0 ptpt -66.44 137.73 57.05 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.464 -179.473 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 65.9 p -85.06 -175.98 5.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.709 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 16.9 mmt85 -61.97 -30.46 70.94 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.809 0.337 . . . . 0.0 111.114 -179.811 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.84 9.04 10.73 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 112.471 0.545 . . . . 0.0 112.471 -178.839 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 66.77 38.46 3.82 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 121.292 0.568 . . . . 0.0 111.393 -178.739 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.463 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 13.9 mm100 -116.95 136.76 52.69 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 177.802 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -93.21 124.7 37.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.839 0.352 . . . . 0.0 111.549 -178.753 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.3 m -129.45 149.23 33.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.672 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.8 m -71.63 134.75 46.57 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.165 0.507 . . . . 0.0 111.523 -178.86 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.9 t -142.86 161.26 38.58 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.337 179.744 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -142.57 155.82 45.04 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.363 0.601 . . . . 0.0 111.848 -179.25 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.446 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.1 tp -135.87 127.19 44.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.067 -0.97 . . . . 0.0 108.721 179.349 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -86.89 115.42 24.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.631 0.253 . . . . 0.0 110.946 -178.526 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.845 HD22 HD22 ' A' ' 69' ' ' LEU . 4.7 mp -85.87 -15.97 40.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.457 179.991 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.91 -47.28 74.58 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.366 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.405 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.5 OUTLIER -92.05 -9.83 41.32 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 122.259 -0.275 . . . . 0.0 111.622 179.723 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.437 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 23.8 m-70 -95.69 -67.02 0.87 Allowed 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 179.535 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.503 HD13 ' CD1' ' A' ' 50' ' ' TRP . 12.9 mm -79.79 148.33 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.486 178.641 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.414 ' HB1' ' OG ' ' A' ' 53' ' ' SER . . . -141.03 171.75 13.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.511 -179.753 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.537 ' C ' HD12 ' A' ' 44' ' ' ILE . 21.0 t30 -113.16 112.8 24.4 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.144 -179.158 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.868 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.4 mp -113.25 88.96 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.952 0.406 . . . . 0.0 110.903 179.276 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 43.5 t0 70.89 38.16 1.2 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.075 179.924 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.72 0.36 89.19 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.161 179.464 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 31.4 m -110.57 135.71 50.8 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 117.107 0.454 . . . . 0.0 110.943 179.923 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 28.3 mt -77.61 118.45 20.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.635 0.731 . . . . 0.0 111.508 -178.114 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.868 ' HB2' HD13 ' A' ' 44' ' ' ILE . 28.4 mttt -137.41 162.75 32.8 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 114.739 -1.119 . . . . 0.0 110.102 -179.938 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.76 ' CE2' HG11 ' A' ' 90' ' ' VAL . 8.0 m-90 -85.95 119.39 26.21 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.921 0.391 . . . . 0.0 111.235 -179.648 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.428 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 14.6 tt0 -174.32 148.26 1.28 Allowed Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.344 -179.798 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.428 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 14.2 Cg_exo -66.43 70.28 0.45 Allowed 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.374 2.049 . . . . 0.0 112.796 -179.061 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.414 ' OG ' ' HB1' ' A' ' 42' ' ' ALA . 3.0 p -162.73 133.67 4.87 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.006 179.026 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -81.19 107.19 13.78 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.402 0.519 . . . . 0.0 112.402 -177.991 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.461 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 50.6 p90 -47.62 -30.84 3.98 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.47 -0.787 . . . . 0.0 110.479 178.219 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 47.2 p -47.28 -17.87 0.09 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 115.496 -0.774 . . . . 0.0 112.874 -179.404 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 46.1 mm-40 -64.85 -30.75 71.77 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.648 0.261 . . . . 0.0 111.14 -179.339 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.501 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.7 p -125.86 4.54 7.35 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.428 179.716 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.5 m -116.84 148.18 41.47 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.286 0.565 . . . . 0.0 111.992 -178.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 43.0 p90 -142.82 157.88 44.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.796 -179.945 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 40.7 m-20 63.02 45.65 5.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.996 0.427 . . . . 0.0 110.421 -179.097 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.752 ' O ' HD22 ' A' ' 13' ' ' LEU . 62.9 m -69.96 136.31 50.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.371 179.803 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -140.77 151.23 44.27 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.719 -179.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.542 HG21 HD13 ' A' ' 19' ' ' LEU . 26.2 mt -130.32 139.7 50.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 CA-C-O 121.287 0.565 . . . . 0.0 111.894 -179.901 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -139.36 111.01 7.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.051 178.901 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 69.15 -123.12 13.9 Favored Glycine 0 N--CA 1.449 -0.495 0 C-N-CA 120.407 -0.901 . . . . 0.0 111.354 -178.644 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.423 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 22.9 p -102.3 -3.75 26.72 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.252 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.641 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.7 t -101.74 139.85 21.84 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.987 0.422 . . . . 0.0 111.627 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.845 HD22 HD22 ' A' ' 37' ' ' LEU . 6.4 tp -102.2 126.87 49.29 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.22 179.84 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.546 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.0 m -117.17 125.15 50.75 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.913 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 11.3 t -151.92 153.65 34.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.629 0.252 . . . . 0.0 111.422 -178.831 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 25.2 m -94.85 126.26 40.06 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.526 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 76.5 m -126.67 145.38 50.6 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.381 0.61 . . . . 0.0 112.577 -178.555 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -74.61 137.46 42.31 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.649 178.362 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 48.5 mtp180 -93.2 144.82 24.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.763 0.316 . . . . 0.0 110.553 179.63 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 m -52.21 -26.12 10.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.488 -179.44 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -82.89 0.24 45.17 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.387 179.9 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.06 136.78 7.45 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.833 179.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 114.33 -166.36 12.15 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 111.062 -0.815 . . . . 0.0 111.062 -178.68 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -132.3 142.82 49.51 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 117.198 0.499 . . . . 0.0 111.299 -179.453 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -153.97 128.8 9.45 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.104 -179.897 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.535 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -92.45 134.82 34.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.652 -179.255 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 60.2 p -122.03 157.99 30.14 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.357 179.755 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 6.5 m -122.44 145.86 47.9 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.754 0.312 . . . . 0.0 111.165 -179.804 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.693 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.7 tt -144.13 143.39 23.61 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 CA-C-N 116.238 -0.437 . . . . 0.0 112.176 -179.526 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -96.41 113.35 24.92 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.7 179.226 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.564 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 12.9 mt -96.5 -5.47 39.36 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -178.878 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.946 ' ND2' HG22 ' A' ' 5' ' ' ILE . 14.0 t-20 -44.71 -28.13 0.58 Allowed 'General case' 0 N--CA 1.467 0.417 0 O-C-N 122.111 -0.368 . . . . 0.0 111.936 -178.581 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 71.5 m -82.19 -39.37 23.25 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -179.896 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.76 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.4 m -72.89 -53.89 17.46 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 113.337 0.866 . . . . 0.0 113.337 -177.92 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.703 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.2 mp -82.57 147.73 5.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 120.935 0.397 . . . . 0.0 111.291 -179.066 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.428 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 6.7 tt0 -138.63 166.63 23.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.229 -178.839 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -107.08 99.77 9.3 Favored 'General case' 0 C--N 1.334 -0.098 0 CA-C-O 121.13 0.49 . . . . 0.0 110.68 -179.769 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.445 HG21 ' CD ' ' A' ' 99' ' ' LYS . 39.2 t -98.33 96.83 5.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.035 179.421 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 29.8 t0 52.98 33.84 15.61 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.616 0.246 . . . . 0.0 111.535 179.893 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.2 28.6 12.91 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.602 -0.809 . . . . 0.0 113.414 179.397 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.6 t -141.24 135.28 30.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.822 0.344 . . . . 0.0 111.015 -179.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.428 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 67.9 mt -74.49 120.11 19.6 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.045 -179.787 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.476 ' O ' ' HA ' ' A' ' 91' ' ' ILE . 10.7 mttm -122.47 139.13 54.22 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.932 -179.966 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.437 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 69.4 t80 -81.58 -29.46 33.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.579 -179.92 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.876 179.816 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.18 0 N-CA-C 112.556 -0.218 . . . . 0.0 112.556 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 6.9 mt -62.51 -46.05 90.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.914 0.388 . . . . 0.0 110.667 179.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -165.72 -72.61 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.961 -0.637 . . . . 0.0 112.203 179.982 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.1 mmtt 61.18 68.17 0.75 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.814 0.34 . . . . 0.0 110.857 179.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.42 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 18.0 p90 -92.21 -39.86 11.3 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.431 -179.889 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.957 HG22 ' ND2' ' A' ' 88' ' ' ASN . 7.0 tp -63.41 -19.95 25.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.737 0.303 . . . . 0.0 111.159 -179.834 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -73.96 -24.01 59.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.438 -0.347 . . . . 0.0 110.676 179.25 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.7 p -118.58 13.96 13.49 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.445 179.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 62.1 m -130.76 154.72 47.69 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.992 0.425 . . . . 0.0 111.066 -179.595 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.406 ' NH2' ' CZ ' ' A' ' 30' ' ' PHE . 15.0 ptp180 -132.99 172.73 12.24 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.04 -179.812 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.427 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.4 p-10 48.51 57.22 6.49 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.949 -0.569 . . . . 0.0 112.164 179.688 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.659 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.9 p -79.24 133.48 36.67 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.255 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.802 ' O ' HD12 ' A' ' 19' ' ' LEU . 1.3 pp0? -157.9 163.77 37.57 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.417 -179.013 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.778 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.43 135.12 39.76 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.949 -179.873 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -119.1 144.98 46.31 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 178.796 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.96 -153.24 30.68 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 119.726 -1.226 . . . . 0.0 111.504 -178.955 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.4 -36.57 19.07 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.351 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.82 35.67 1.78 Allowed 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.804 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.432 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 10.7 mp0 -115.95 148.91 39.56 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.092 0.472 . . . . 0.0 111.985 178.892 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.805 ' CB ' HD11 ' A' ' 37' ' ' LEU . 15.4 tp -123.79 124.61 43.07 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.173 179.012 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -118.26 143.27 46.7 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.712 -0.477 . . . . 0.0 109.712 179.68 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.36 172.63 16.22 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.463 -178.438 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -113.53 133.51 55.21 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 177.532 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 63.3 m -131.03 134.76 46.97 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.117 0.484 . . . . 0.0 111.962 -179.082 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -67.27 136.49 55.0 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.526 -179.613 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.42 HG22 ' HA3' ' A' ' 96' ' ' GLY . 65.4 p -86.29 -178.9 6.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.476 -0.784 . . . . 0.0 110.521 179.814 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 5.7 mtt180 -60.29 -29.22 68.68 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.785 0.326 . . . . 0.0 110.957 -179.712 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.75 8.53 9.81 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 112.589 0.589 . . . . 0.0 112.589 -178.798 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 58.6 mt-30 66.66 38.13 4.1 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 121.324 0.583 . . . . 0.0 111.086 -178.692 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.427 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 9.9 mt-30 -119.8 135.57 54.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.039 178.376 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.406 ' CZ ' ' NH2' ' A' ' 9' ' ' ARG . 50.3 m-85 -92.77 124.73 36.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.963 0.411 . . . . 0.0 111.35 -178.981 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.4 m -128.64 151.02 34.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.91 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.4 p -70.95 133.01 46.05 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.168 0.509 . . . . 0.0 111.835 -178.555 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.2 t -143.4 161.42 38.42 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.323 179.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -143.77 155.28 44.11 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.231 0.539 . . . . 0.0 111.904 -178.936 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.736 HD11 ' HD1' ' A' ' 100' ' ' TYR . 1.1 tp -135.44 126.36 44.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.274 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -87.2 117.23 25.81 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.709 0.29 . . . . 0.0 111.136 -178.337 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.909 HD22 HD22 ' A' ' 69' ' ' LEU . 3.9 mp -87.74 -15.59 36.61 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.986 -179.623 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -58.24 -43.5 87.85 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.39 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.416 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 4.0 m-20 -91.97 -10.08 40.65 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.024 -0.423 . . . . 0.0 111.195 179.084 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.501 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 25.8 m-70 -96.74 -63.06 1.17 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 179.633 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.624 HD11 HD22 ' A' ' 87' ' ' LEU . 24.1 mm -80.59 149.87 4.96 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.547 178.443 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.527 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.0 172.05 13.32 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.398 -179.773 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.439 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 32.4 t30 -112.7 107.8 16.59 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.751 -0.658 . . . . 0.0 111.017 -179.021 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 48.0 mm -109.81 91.07 1.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.182 179.941 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.7 t70 66.25 39.58 4.1 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.005 -179.822 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 81.39 1.18 89.97 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.729 179.889 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.0 m -108.56 137.74 46.01 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.912 0.387 . . . . 0.0 111.253 -179.883 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.465 HD12 ' O ' ' A' ' 83' ' ' SER . 20.4 mt -77.19 115.82 17.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.592 0.711 . . . . 0.0 111.341 -178.151 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -137.71 162.83 32.83 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 114.691 -1.14 . . . . 0.0 110.201 -179.974 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.756 ' CZ3' HD11 ' A' ' 85' ' ' ILE . 5.8 m-90 -86.67 122.38 30.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.892 0.377 . . . . 0.0 111.717 -179.35 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.527 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 1.8 mt-30 -172.14 149.52 2.21 Favored Pre-proline 0 N--CA 1.467 0.391 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.133 -179.952 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.416 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 53.7 Cg_endo -71.66 64.85 3.07 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 121.932 1.754 . . . . 0.0 112.353 -179.811 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.2 p -157.61 134.09 9.74 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.709 -1.132 . . . . 0.0 108.174 179.02 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.422 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.2 OUTLIER -81.04 110.13 16.27 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.699 0.629 . . . . 0.0 112.699 -177.509 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.435 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 47.9 p90 -49.25 -30.31 7.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.314 -0.857 . . . . 0.0 110.88 178.529 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.4 p -49.33 -18.15 0.34 Allowed 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -179.025 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -62.21 -28.07 69.43 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.889 -0.324 . . . . 0.0 111.17 -179.104 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.439 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -128.73 -1.89 5.38 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 179.703 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 72' ' ' THR . 5.8 m -108.72 149.43 29.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.125 0.488 . . . . 0.0 112.083 -178.594 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 6.2 p90 -141.52 157.26 45.35 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.301 179.903 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 64.14 47.68 3.21 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.84 -179.197 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.778 ' O ' HD22 ' A' ' 13' ' ' LEU . 55.8 m -70.1 135.38 49.16 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.788 179.73 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -142.29 152.32 42.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.714 -179.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.597 HG21 HD13 ' A' ' 19' ' ' LEU . 45.7 mt -130.96 140.33 48.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.253 0.549 . . . . 0.0 111.974 -179.724 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 -136.26 109.77 7.96 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.274 179.208 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.47 -119.82 13.6 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 120.303 -0.951 . . . . 0.0 110.939 -178.457 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.413 ' HB3' ' HB ' ' A' ' 5' ' ' ILE . 24.8 p -102.34 -3.29 27.36 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.464 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.495 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.5 t -101.9 136.97 31.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 121.022 0.439 . . . . 0.0 111.811 179.975 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.909 HD22 HD22 ' A' ' 37' ' ' LEU . 5.3 tp -101.8 125.48 48.48 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.301 179.813 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.546 ' N ' HD12 ' A' ' 69' ' ' LEU . 16.7 m -115.46 126.36 54.23 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 10.5 t -151.77 153.54 34.48 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.792 0.33 . . . . 0.0 111.649 -178.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 3.6 m -95.42 126.02 40.43 Favored 'General case' 0 C--N 1.333 -0.136 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 178.812 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.9 m -126.19 144.5 50.74 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -178.598 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -74.31 137.64 43.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.375 178.037 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 40.2 mtm-85 -91.94 142.37 27.63 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.668 0.27 . . . . 0.0 110.593 179.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.2 m -52.21 -27.0 13.03 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.5 -0.318 . . . . 0.0 111.612 -179.361 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 23.2 t-20 -83.05 1.98 37.4 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.706 0.289 . . . . 0.0 111.393 179.924 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.49 134.07 6.53 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.497 -179.873 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.11 -171.07 13.58 Favored Glycine 0 C--N 1.318 -0.459 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.625 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -132.19 144.19 50.48 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 117.28 0.54 . . . . 0.0 111.337 -179.905 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -154.39 132.29 11.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.245 179.879 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.497 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.5 t -94.45 134.44 36.98 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.306 -179.642 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.465 ' O ' HD12 ' A' ' 48' ' ' LEU . 38.3 p -120.61 158.28 27.72 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.283 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.07 144.33 48.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.26 -179.646 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.756 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 13.4 tt -144.51 143.83 22.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.146 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.693 179.913 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 29.8 t0 -98.0 118.31 34.32 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.942 179.524 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.636 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 4.8 mt -100.32 -6.05 26.45 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -179.06 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.957 ' ND2' HG22 ' A' ' 5' ' ' ILE . 14.1 t-20 -44.63 -28.25 0.58 Allowed 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -178.349 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 13.2 m -82.2 -39.53 22.99 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 112.829 0.677 . . . . 0.0 112.829 -179.811 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.659 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -72.32 -52.62 23.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 N-CA-C 113.445 0.905 . . . . 0.0 113.445 -177.943 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.515 HD12 ' CG2' ' A' ' 90' ' ' VAL . 2.7 mp -81.55 147.3 6.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-O 121.131 0.491 . . . . 0.0 111.238 -179.17 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.45 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 15.3 tt0 -137.62 165.63 25.88 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.061 -178.617 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.3 t30 -107.63 100.16 9.58 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.235 0.54 . . . . 0.0 110.728 -179.815 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 34.2 t -98.34 98.44 7.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.78 179.039 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.8 t0 54.17 32.55 16.14 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.672 0.272 . . . . 0.0 111.41 -179.801 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.42 ' HA3' HG22 ' A' ' 25' ' ' THR . . . 93.49 28.46 11.41 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.316 179.297 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 3.1 m -140.38 137.35 33.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.918 0.39 . . . . 0.0 111.571 -179.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.45 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 57.0 mt -74.38 119.04 18.04 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.686 179.873 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.434 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.5 mttm -126.57 145.35 50.57 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.671 -179.112 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.736 ' HD1' HD11 ' A' ' 35' ' ' ILE . 1.0 OUTLIER -91.55 138.42 31.58 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.023 179.406 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.232 -0.889 . . . . 0.0 111.003 -179.748 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.181 0 N-CA-C 112.55 -0.22 . . . . 0.0 112.55 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.498 ' N ' HD23 ' A' ' 1' ' ' LEU . 2.6 pt? -173.62 -39.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.694 0.283 . . . . 0.0 111.111 -179.938 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -58.46 153.12 28.74 Favored Glycine 0 CA--C 1.52 0.362 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.425 179.652 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.3 mttt -155.1 89.65 1.23 Allowed 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.786 0.293 . . . . 0.0 111.255 179.915 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.417 ' CD1' ' HB ' ' A' ' 91' ' ' ILE . 13.2 p90 -98.42 -39.06 8.96 Favored 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.928 HG22 ' ND2' ' A' ' 88' ' ' ASN . 8.5 tp -62.64 -19.14 22.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-O 120.601 0.239 . . . . 0.0 111.544 -179.467 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -74.38 -25.64 59.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.615 0.245 . . . . 0.0 111.037 179.293 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 61.1 p -118.91 -0.94 11.09 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.641 179.287 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 80.6 m -109.84 151.42 27.03 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.898 0.38 . . . . 0.0 111.279 -179.706 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.1 172.24 12.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.015 179.721 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 48.88 58.76 4.98 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 112.438 0.533 . . . . 0.0 112.438 -179.871 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.749 HG21 ' CD1' ' A' ' 5' ' ' ILE . 12.6 p -79.25 134.07 36.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.84 178.622 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.69 ' O ' HD12 ' A' ' 19' ' ' LEU . 2.5 pt20 -157.26 163.65 38.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.507 -179.183 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.774 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.66 135.42 39.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.097 -179.869 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -118.61 144.17 46.31 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.995 -0.742 . . . . 0.0 108.995 178.657 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.81 -152.11 32.3 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 119.753 -1.213 . . . . 0.0 111.566 -179.01 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.99 -36.64 18.14 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.413 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.1 p -140.73 34.87 1.79 Allowed 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 -178.588 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.4 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 0.8 OUTLIER -115.36 148.54 39.17 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.106 0.479 . . . . 0.0 112.06 178.788 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.817 ' CB ' HD11 ' A' ' 37' ' ' LEU . 12.6 tp -122.31 123.76 42.17 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.46 179.504 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -120.07 143.97 47.84 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.901 0.381 . . . . 0.0 110.031 179.405 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.6 172.56 16.13 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.876 -178.539 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -112.56 133.57 54.55 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 176.893 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 58.4 m -130.59 133.57 46.29 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 120.51 -0.476 . . . . 0.0 112.026 -178.924 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 3.7 ptpt -66.03 136.95 56.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.664 -179.78 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.496 HG22 ' O ' ' A' ' 95' ' ' ASP . 63.7 p -85.98 -176.92 6.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.566 179.872 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.0 mtm180 -61.52 -29.72 70.18 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.674 0.273 . . . . 0.0 111.183 179.926 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.0 8.39 10.71 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 -178.622 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 66.26 38.08 4.69 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.216 0.531 . . . . 0.0 111.196 -178.725 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.412 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 32.9 mt-30 -118.58 135.83 54.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.221 -0.9 . . . . 0.0 108.664 178.307 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -92.88 124.53 36.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.061 0.458 . . . . 0.0 111.786 -178.518 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.7 m -130.3 151.29 35.65 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.723 -179.983 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 9.4 t -72.44 136.46 46.01 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.166 0.508 . . . . 0.0 112.079 -178.723 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 1.7 t -145.13 161.72 38.8 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.265 179.884 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt -143.1 157.19 44.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.48 0.657 . . . . 0.0 112.177 -179.215 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.467 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.7 OUTLIER -136.74 125.6 36.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.922 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -88.32 119.56 28.85 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.621 0.248 . . . . 0.0 110.977 -177.93 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 69' ' ' LEU . 3.9 mp -88.94 -14.88 35.63 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.488 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 3.2 p-10 -57.4 -45.61 84.35 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.222 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.436 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 3.8 p30 -92.83 -10.48 36.64 Favored 'General case' 0 N--CA 1.467 0.413 0 O-C-N 121.906 -0.496 . . . . 0.0 111.377 178.567 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.47 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 9.5 m-70 -94.29 -66.07 0.94 Allowed 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.959 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.622 HD12 ' N ' ' A' ' 41' ' ' ILE . 1.6 mp -81.24 150.64 4.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.784 -0.643 . . . . 0.0 109.938 178.809 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.542 ' HB3' ' HB2' ' A' ' 51' ' ' GLN . . . -140.98 171.68 13.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.808 -179.032 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.541 ' C ' HD12 ' A' ' 44' ' ' ILE . 23.7 t30 -113.25 111.52 22.18 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.367 -179.202 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.79 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.4 mp -112.45 89.32 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 CA-C-O 120.918 0.389 . . . . 0.0 111.161 179.731 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 28.4 t0 67.32 38.13 3.37 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.937 179.369 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.54 0.85 87.98 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.473 -0.87 . . . . 0.0 113.158 179.307 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 4.1 m -112.94 136.48 52.56 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.193 0.496 . . . . 0.0 110.842 179.776 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 22.9 mt -77.38 117.97 19.38 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.649 0.738 . . . . 0.0 112.541 -177.521 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.79 ' HB2' HD13 ' A' ' 44' ' ' ILE . 40.6 mttt -139.61 163.01 33.7 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 114.439 -1.255 . . . . 0.0 109.545 179.475 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.766 ' CH2' HD11 ' A' ' 85' ' ' ILE . 9.5 m-90 -87.7 127.08 35.3 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.892 0.331 . . . . 0.0 111.892 -179.4 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.542 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.1 OUTLIER -172.92 159.14 3.57 Favored Pre-proline 0 N--CA 1.468 0.432 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.686 -179.785 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -77.02 61.55 7.21 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 122.118 1.879 . . . . 0.0 112.142 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.1 p -156.47 135.34 11.82 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.85 -1.068 . . . . 0.0 108.599 179.193 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -82.29 109.87 16.95 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.227 0.536 . . . . 0.0 112.139 -178.182 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -46.41 -30.02 1.96 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.087 178.764 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.6 p -50.65 -17.11 0.47 Allowed 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 113.101 0.778 . . . . 0.0 113.101 -179.049 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.6 mm-40 -61.2 -29.37 69.77 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.906 -0.318 . . . . 0.0 110.838 -179.308 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.404 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.3 p -129.68 0.63 4.92 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.616 -0.265 . . . . 0.0 111.531 179.249 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.9 m -110.86 148.3 32.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.3 0.572 . . . . 0.0 112.06 -178.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.7 p90 -141.72 157.53 44.94 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.294 -0.866 . . . . 0.0 110.021 -179.682 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 63.71 45.62 4.44 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.912 0.387 . . . . 0.0 110.879 -179.356 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.774 ' O ' HD22 ' A' ' 13' ' ' LEU . 58.1 m -69.01 137.2 53.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.513 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.408 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -143.58 152.13 41.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.185 -0.461 . . . . 0.0 112.071 -179.433 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.507 HG21 HD13 ' A' ' 19' ' ' LEU . 39.9 mt -131.01 140.27 49.05 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 121.302 0.573 . . . . 0.0 112.239 -179.898 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -137.88 110.68 7.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.273 179.271 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 66.66 -121.71 17.95 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.368 -0.92 . . . . 0.0 111.171 -178.602 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.414 ' HB3' HG21 ' A' ' 5' ' ' ILE . 21.1 p -100.49 -2.92 31.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.984 0.392 . . . . 0.0 112.002 -179.408 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.579 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.4 t -103.57 138.41 28.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.207 0 N-CA-C 112.366 0.506 . . . . 0.0 112.366 -179.633 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.894 HD22 HD22 ' A' ' 37' ' ' LEU . 6.7 tp -102.85 124.64 48.75 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.615 179.606 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.466 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.7 m -115.52 126.65 54.54 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -179.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.2 t -151.89 153.8 34.87 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.128 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 8.3 m -95.06 126.42 40.39 Favored 'General case' 0 C--O 1.231 0.092 0 N-CA-C 109.918 -0.401 . . . . 0.0 109.918 178.814 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 73.4 m -127.32 146.3 50.49 Favored 'General case' 0 C--N 1.332 -0.176 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -178.266 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -75.82 137.29 40.4 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.631 178.042 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 47.8 mtm-85 -92.06 146.04 24.05 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.743 0.306 . . . . 0.0 110.601 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.1 m -51.92 -31.41 28.48 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.851 -179.169 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 75.2 m-20 -81.74 2.82 28.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.519 -0.309 . . . . 0.0 111.619 -179.739 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.19 136.27 6.83 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.913 -0.661 . . . . 0.0 112.34 -179.82 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 117.0 -173.46 14.71 Favored Glycine 0 C--N 1.317 -0.498 0 N-CA-C 110.959 -0.856 . . . . 0.0 110.959 -178.41 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -131.65 143.24 50.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 117.398 0.599 . . . . 0.0 111.484 -179.798 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 37.3 t-20 -154.44 130.81 10.48 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.38 179.563 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 0.9 OUTLIER -92.46 134.28 35.1 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.157 -179.763 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 54.6 p -119.72 158.65 26.06 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.383 -179.815 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -122.47 144.66 48.92 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.338 -179.52 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.766 HD11 ' CH2' ' A' ' 50' ' ' TRP . 11.8 tt -146.97 145.01 19.71 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.577 179.728 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -98.25 118.7 35.47 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.648 179.502 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.533 HD23 ' CZ2' ' A' ' 50' ' ' TRP . 7.0 mt -99.72 -6.46 27.07 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -178.738 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.928 ' ND2' HG22 ' A' ' 5' ' ' ILE . 5.6 t-20 -45.06 -28.61 0.73 Allowed 'General case' 0 N--CA 1.468 0.442 0 O-C-N 122.17 -0.331 . . . . 0.0 111.825 -178.532 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 7.5 m -80.35 -39.61 28.22 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.705 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.0 m -73.5 -52.58 20.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -178.367 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.614 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.1 mp -81.75 147.32 6.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 120.927 0.394 . . . . 0.0 111.235 -179.174 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -137.16 165.42 26.14 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.179 -178.709 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -106.4 99.83 9.39 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-O 121.133 0.492 . . . . 0.0 110.708 -179.651 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 38.7 t -99.26 96.75 5.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.171 179.408 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.496 ' O ' HG22 ' A' ' 25' ' ' THR . 15.8 t0 52.7 33.37 13.74 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 179.742 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.23 28.43 11.72 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.748 -0.739 . . . . 0.0 113.206 179.235 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 33.0 t -141.63 134.31 28.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.779 0.323 . . . . 0.0 111.174 -179.831 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.409 ' CB ' ' HB ' ' A' ' 35' ' ' ILE . 73.8 mt -74.75 120.34 20.16 Favored 'General case' 0 C--O 1.232 0.156 0 CA-C-O 121.054 0.454 . . . . 0.0 110.88 179.923 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 19.4 mttt -123.3 138.97 54.5 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.281 -179.71 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.47 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 36.2 t80 -83.38 85.77 7.18 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.476 179.518 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.309 -0.853 . . . . 0.0 110.833 -179.899 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.16 0 N-CA-C 112.457 -0.257 . . . . 0.0 112.457 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.9 tt 61.58 97.52 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.808 0.337 . . . . 0.0 110.781 -179.93 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 92.14 -114.77 4.64 Favored Glycine 0 N--CA 1.452 -0.238 0 C-N-CA 120.848 -0.691 . . . . 0.0 112.321 -179.781 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.9 mttt 59.65 65.54 1.13 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.986 0.422 . . . . 0.0 110.786 179.997 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.464 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 22.7 p90 -89.88 -39.18 13.21 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.289 179.968 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.954 HG22 ' ND2' ' A' ' 88' ' ' ASN . 6.4 tp -64.46 -16.32 19.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-O 120.714 0.292 . . . . 0.0 111.397 -179.871 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -76.04 -24.95 55.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.817 0.342 . . . . 0.0 110.802 179.36 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.4 p -118.29 -4.04 10.96 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.656 179.775 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 60.4 m -109.69 153.64 23.99 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.161 0.505 . . . . 0.0 111.067 -179.557 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 22.2 ptt180 -132.27 173.03 11.69 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.615 -179.948 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.402 ' ND2' ' O ' ' A' ' 10' ' ' ASN . 5.9 p-10 49.12 58.01 5.85 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.011 0.434 . . . . 0.0 112.027 179.867 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.616 HG21 ' CD1' ' A' ' 5' ' ' ILE . 3.1 p -79.31 130.02 35.03 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.952 178.801 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.708 ' O ' HD12 ' A' ' 19' ' ' LEU . 1.8 pt20 -156.15 163.15 39.97 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.38 -179.403 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.72 HD22 ' O ' ' A' ' 62' ' ' SER . 0.6 OUTLIER -97.64 136.57 37.82 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.467 179.901 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -121.03 144.6 48.45 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.071 179.273 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 58.21 -152.09 29.86 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 119.85 -1.167 . . . . 0.0 111.36 -178.759 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 m -86.16 -37.07 19.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.098 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 55' ' ' PHE . 3.0 p -141.34 36.59 1.69 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 112.749 0.648 . . . . 0.0 112.749 -178.92 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 3.2 mp0 -115.71 145.74 42.5 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.15 0.5 . . . . 0.0 111.512 178.922 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.806 ' CB ' HD11 ' A' ' 37' ' ' LEU . 13.3 tp -119.92 123.79 44.42 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 178.913 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -117.29 142.89 46.52 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.876 0.369 . . . . 0.0 110.041 179.595 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.22 172.28 16.96 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.001 -178.795 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -114.39 133.55 55.63 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 177.69 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.407 ' SG ' HD21 ' A' ' 98' ' ' LEU . 39.4 m -130.61 133.38 46.11 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.134 0.492 . . . . 0.0 111.709 -179.12 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 3.1 ptpt -66.59 137.99 57.15 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.451 -179.624 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 21.1 p -85.48 -177.13 6.36 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.637 179.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 15.4 mtt-85 -61.33 -30.35 70.45 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.46 -0.337 . . . . 0.0 111.298 -179.673 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.77 9.46 9.7 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 112.354 0.502 . . . . 0.0 112.354 -179.099 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 66.84 38.34 3.77 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.223 0.535 . . . . 0.0 111.609 -178.838 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.503 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 16.0 mm100 -116.8 137.68 52.03 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.811 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -94.65 124.77 38.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.896 0.379 . . . . 0.0 111.883 -178.778 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 23.5 m -130.47 151.47 35.95 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.914 179.543 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 4.3 m -72.45 134.87 45.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.223 0.535 . . . . 0.0 111.617 -178.842 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.2 t -141.75 161.51 37.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.443 -0.799 . . . . 0.0 110.002 179.713 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -140.74 154.14 46.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.462 0.649 . . . . 0.0 112.007 -178.895 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.477 HG23 ' HB3' ' A' ' 19' ' ' LEU . 1.0 OUTLIER -138.36 122.58 21.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.0 -1.0 . . . . 0.0 108.61 179.214 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -86.57 119.14 26.5 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.824 0.345 . . . . 0.0 110.863 -178.646 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.848 HD22 HD22 ' A' ' 69' ' ' LEU . 4.4 mp -87.0 -15.56 38.34 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.757 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.447 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 1.2 p-10 -57.49 -45.92 84.31 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.024 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.447 ' N ' ' OD1' ' A' ' 38' ' ' ASP . 1.3 m-20 -92.13 -10.04 40.33 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 122.101 -0.375 . . . . 0.0 111.53 179.599 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 39.4 m-70 -98.63 -67.45 0.85 Allowed 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 179.799 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.561 HD12 ' N ' ' A' ' 41' ' ' ILE . 3.3 mp -81.13 149.71 4.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.407 178.783 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.474 ' HB3' ' CG ' ' A' ' 51' ' ' GLN . . . -141.4 172.57 12.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.148 -179.37 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.482 ' ND2' ' OG1' ' A' ' 58' ' ' THR . 12.9 t30 -112.45 114.68 27.5 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.98 179.682 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.703 HD11 ' OE1' ' A' ' 51' ' ' GLN . 49.7 mm -113.41 89.35 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.384 -179.641 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 56.8 t0 71.12 38.53 1.08 Allowed 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.95 179.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.41 0.68 88.25 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.545 -0.836 . . . . 0.0 112.889 179.779 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 10.9 m -115.2 136.29 53.26 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 120.917 0.389 . . . . 0.0 110.814 179.793 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 13.6 mt -77.5 120.26 22.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.516 0.674 . . . . 0.0 111.545 -178.16 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -135.37 162.06 33.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 114.852 -1.067 . . . . 0.0 109.873 179.877 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.769 ' CE2' HG11 ' A' ' 90' ' ' VAL . 8.0 m-90 -89.2 117.61 28.3 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.061 0.458 . . . . 0.0 112.193 -179.065 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.703 ' OE1' HD11 ' A' ' 44' ' ' ILE . 3.0 pt20 -178.55 151.12 0.72 Allowed Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.974 178.656 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.415 ' HA ' ' O ' ' A' ' 39' ' ' ASP . 28.4 Cg_endo -63.21 81.98 0.12 Allowed 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 122.263 1.975 . . . . 0.0 113.118 -178.697 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.414 ' OG ' ' CB ' ' A' ' 42' ' ' ALA . 3.0 p -172.38 131.92 0.61 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.018 178.938 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -81.81 108.87 15.69 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -177.921 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 25.1 p90 -47.91 -29.77 3.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.469 178.544 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 88.7 p -48.8 -15.92 0.11 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -179.217 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -64.63 -30.79 71.82 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.075 -0.25 . . . . 0.0 111.599 -178.79 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.482 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.2 p -129.75 2.81 4.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.504 0.192 . . . . 0.0 111.301 179.763 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 72' ' ' THR . 7.6 m -112.2 148.03 34.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.207 0.527 . . . . 0.0 111.827 -179.013 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 36.2 p90 -142.48 157.37 44.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.017 -179.724 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 63.33 47.61 3.92 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.961 0.41 . . . . 0.0 110.693 -179.187 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.72 ' O ' HD22 ' A' ' 13' ' ' LEU . 21.1 m -70.11 136.36 50.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.598 179.865 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.513 ' O ' HD12 ' A' ' 69' ' ' LEU . . . -142.04 152.09 43.04 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.494 179.791 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.499 HG21 HD13 ' A' ' 19' ' ' LEU . 34.6 mt -130.28 140.6 48.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 121.219 0.533 . . . . 0.0 111.649 -179.933 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -137.44 110.6 7.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.236 -0.893 . . . . 0.0 108.99 179.059 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.68 -122.33 16.9 Favored Glycine 0 N--CA 1.448 -0.533 0 C-N-CA 120.24 -0.981 . . . . 0.0 111.179 -178.651 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.427 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 20.8 p -101.18 -4.33 27.43 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -179.521 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.509 HG13 ' O ' ' A' ' 85' ' ' ILE . 5.5 t -101.74 139.56 22.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.969 0.414 . . . . 0.0 111.691 -179.977 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.848 HD22 HD22 ' A' ' 37' ' ' LEU . 8.0 tp -102.22 127.82 49.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.356 179.834 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.524 ' N ' HD12 ' A' ' 69' ' ' LEU . 6.8 m -117.24 124.34 48.82 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.034 -0.358 . . . . 0.0 110.034 179.902 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 5.6 t -151.26 153.32 34.64 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.686 -0.233 . . . . 0.0 111.159 -178.881 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 7.9 m -93.14 125.96 38.0 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 179.015 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 74.3 m -127.14 144.34 51.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.316 0.579 . . . . 0.0 112.52 -178.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -74.84 138.1 42.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.857 178.454 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 59.5 mtp180 -92.65 143.55 26.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.66 0.267 . . . . 0.0 110.53 179.753 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 32.2 m -51.83 -25.63 8.2 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.565 -0.288 . . . . 0.0 111.448 -179.429 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 -82.79 0.84 41.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.762 0.315 . . . . 0.0 111.442 -179.989 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.36 135.86 6.73 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.945 -0.645 . . . . 0.0 112.437 -179.935 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.55 -168.49 12.76 Favored Glycine 0 C--N 1.319 -0.386 0 N-CA-C 111.298 -0.721 . . . . 0.0 111.298 -178.742 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 -131.19 141.63 50.08 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 117.145 0.473 . . . . 0.0 111.246 -179.626 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -154.28 130.71 10.54 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.26 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.527 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 1.8 t -93.35 134.37 35.63 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.303 -179.478 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.9 p -120.9 158.47 27.59 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.902 0.382 . . . . 0.0 110.542 179.911 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 60.5 p -120.6 143.74 48.48 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.879 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.751 HD11 ' CZ3' ' A' ' 50' ' ' TRP . 14.4 tt -144.51 142.07 23.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.382 -179.751 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -96.31 116.6 29.28 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.213 179.876 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.662 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 10.0 mt -96.64 -6.64 36.18 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 113.074 0.768 . . . . 0.0 113.074 -179.025 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.954 ' ND2' HG22 ' A' ' 5' ' ' ILE . 12.1 t-20 -44.99 -29.48 0.84 Allowed 'General case' 0 N--CA 1.466 0.355 0 O-C-N 122.186 -0.322 . . . . 0.0 111.705 -178.652 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.75 -41.0 24.24 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 -179.947 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.769 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.2 m -71.01 -53.19 22.46 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 N-CA-C 113.358 0.874 . . . . 0.0 113.358 -177.91 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.57 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.81 147.79 5.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.992 0.425 . . . . 0.0 111.568 -178.836 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.412 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 13.4 tt0 -137.02 165.66 25.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.866 -179.074 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -107.57 99.71 9.19 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.112 0.482 . . . . 0.0 110.25 179.837 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.401 HG23 ' HB2' ' A' ' 99' ' ' LYS . 38.9 t -98.81 96.69 5.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-N 115.593 -0.731 . . . . 0.0 111.136 179.736 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 28.8 t0 52.75 33.99 15.23 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.716 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 93.5 28.07 12.05 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.845 -0.693 . . . . 0.0 113.389 179.155 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.1 t -141.89 135.46 29.52 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.789 0.328 . . . . 0.0 111.401 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.412 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 64.3 mt -73.59 119.26 17.57 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.425 179.782 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.405 ' O ' ' N ' ' A' ' 92' ' ' GLU . 8.0 mttm -125.29 148.63 48.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.647 -178.995 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 16.9 t80 -95.19 81.28 3.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.902 -179.841 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.961 179.985 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' -1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.215 0 N-CA-C 112.519 -0.233 . . . . 0.0 112.519 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 12.8 tp 64.83 140.05 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.828 0.347 . . . . 0.0 111.111 179.988 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 104.17 -107.76 3.02 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.019 -179.77 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 63.54 68.58 0.59 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.834 0.349 . . . . 0.0 111.336 179.36 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.407 ' CE1' ' HA ' ' A' ' 88' ' ' ASN . 15.8 p90 -92.49 -37.89 12.26 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.194 179.584 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.954 HG22 ' ND2' ' A' ' 88' ' ' ASN . 3.9 tp -66.06 -13.64 16.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.727 0.299 . . . . 0.0 111.101 179.838 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -77.34 -27.36 52.74 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.016 0.436 . . . . 0.0 109.874 178.932 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 42.6 p -118.74 11.22 12.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.899 -0.592 . . . . 0.0 111.138 178.755 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 74.7 m -124.94 149.88 47.18 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.153 0.501 . . . . 0.0 111.616 -179.043 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 13.3 ptm180 -133.64 173.0 11.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.797 179.764 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.1 p30 49.99 56.91 7.16 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.792 0.437 . . . . 0.0 112.07 -179.743 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.801 HG21 ' CD1' ' A' ' 5' ' ' ILE . 25.0 p -79.27 133.8 36.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.898 178.588 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.688 ' O ' HD12 ' A' ' 19' ' ' LEU . 5.9 pt20 -157.09 163.68 38.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.571 -179.166 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.761 HD22 ' O ' ' A' ' 62' ' ' SER . 0.7 OUTLIER -97.7 136.08 38.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.905 -179.975 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 18' ' ' GLU . . . -120.92 144.31 48.51 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 179.1 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 59.67 -152.92 34.07 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 119.866 -1.159 . . . . 0.0 111.281 -178.859 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.9 m -85.57 -37.05 20.02 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.43 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 3.0 p -142.09 35.61 1.54 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -179.085 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 14' ' ' ALA . 2.1 mp0 -113.28 147.27 37.91 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.959 0.409 . . . . 0.0 111.511 178.604 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.807 ' CB ' HD11 ' A' ' 37' ' ' LEU . 11.9 tp -119.65 124.79 47.14 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.983 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -121.01 143.32 49.11 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 179.531 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -161.65 172.64 15.94 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.187 -178.795 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -111.2 133.85 53.23 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 177.044 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 70.3 m -130.82 133.98 46.43 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.124 0.488 . . . . 0.0 111.881 -179.089 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.434 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 8.3 ptpt -66.03 136.79 56.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.382 -179.606 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.8 p -85.45 -176.29 6.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.52 179.85 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 39.4 mtm180 -61.54 -30.68 70.8 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.642 0.258 . . . . 0.0 111.316 -179.615 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.86 9.89 10.97 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -179.097 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 66.57 39.45 3.75 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.263 0.554 . . . . 0.0 111.614 -178.795 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.434 ' O ' ' HA ' ' A' ' 24' ' ' LYS . 50.0 mt-30 -117.12 136.44 53.0 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.565 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 35.9 m-85 -92.56 124.33 36.51 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 120.44 -0.504 . . . . 0.0 111.614 -178.688 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 5.6 m -128.89 149.08 33.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.354 179.448 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.7 m -72.36 136.7 46.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.269 0.557 . . . . 0.0 111.616 -178.847 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 2.8 t -142.17 161.21 38.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.148 179.668 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.9 154.22 47.19 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.394 0.616 . . . . 0.0 112.012 -179.379 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.512 HG23 ' HB3' ' A' ' 19' ' ' LEU . 0.8 OUTLIER -136.89 126.43 37.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.096 -0.957 . . . . 0.0 108.858 179.656 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -87.94 115.52 25.46 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.609 0.243 . . . . 0.0 111.622 -178.032 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.912 HD22 HD22 ' A' ' 69' ' ' LEU . 3.8 mp -87.03 -16.33 35.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.22 179.359 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.66 -45.13 81.86 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-O 120.691 0.281 . . . . 0.0 111.399 -178.863 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.409 ' O ' ' HA ' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -92.05 -10.49 38.95 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 122.241 -0.287 . . . . 0.0 111.617 179.633 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.487 ' CE1' ' CG ' ' A' ' 100' ' ' TYR . 17.7 m-70 -97.43 -64.47 1.04 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.74 -0.467 . . . . 0.0 109.74 179.908 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.503 HD11 HD22 ' A' ' 87' ' ' LEU . 29.8 mm -79.77 148.05 6.15 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.645 179.026 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.428 ' HB2' ' O ' ' A' ' 51' ' ' GLN . . . -140.01 172.04 13.33 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.603 -179.775 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.54 ' C ' HD12 ' A' ' 44' ' ' ILE . 32.9 t30 -113.02 111.23 21.81 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.378 -178.939 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.763 HD13 ' HB2' ' A' ' 49' ' ' LYS . 2.2 mp -111.21 89.49 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.915 179.289 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.1 t70 67.95 38.14 2.87 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.105 -179.958 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.71 2.39 88.71 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.627 -0.797 . . . . 0.0 113.231 179.448 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 3.2 m -111.5 136.32 50.83 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 117.201 0.501 . . . . 0.0 111.162 -179.946 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 43.1 mt -77.5 117.47 18.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.616 0.722 . . . . 0.0 111.384 -178.199 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.763 ' HB2' HD13 ' A' ' 44' ' ' ILE . 8.9 mttm -138.45 163.01 33.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.128 -179.841 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' TRP . . . . . 0.726 ' CE2' HG11 ' A' ' 90' ' ' VAL . 7.3 m-90 -85.91 119.82 26.63 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.991 0.424 . . . . 0.0 111.493 -179.464 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.454 ' CG ' ' HD2' ' A' ' 52' ' ' PRO . 40.5 tt0 -174.99 143.52 0.77 Allowed Pre-proline 0 N--CA 1.463 0.221 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.359 -179.983 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.454 ' HD2' ' CG ' ' A' ' 51' ' ' GLN . 29.6 Cg_endo -64.68 72.09 0.22 Allowed 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 122.289 1.993 . . . . 0.0 112.868 -179.171 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.4 ' N ' ' O ' ' A' ' 51' ' ' GLN . 3.9 p -163.44 133.8 4.43 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.058 -0.974 . . . . 0.0 108.4 178.932 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.47 ' OD1' ' N ' ' A' ' 54' ' ' ASN . 0.1 OUTLIER -80.41 109.88 15.33 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 112.451 0.537 . . . . 0.0 112.451 -177.682 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 17' ' ' SER . 12.7 p90 -50.09 -30.47 11.05 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.721 178.522 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.421 ' N ' ' CD1' ' A' ' 55' ' ' PHE . 77.3 p -48.4 -19.63 0.33 Allowed 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -179.196 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -60.49 -26.29 66.71 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.944 -0.302 . . . . 0.0 111.073 -179.096 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.449 ' OG1' ' ND2' ' A' ' 43' ' ' ASN . 5.0 p -132.08 0.29 3.8 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 121.085 -0.246 . . . . 0.0 111.501 179.204 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 72' ' ' THR . 5.3 m -110.95 148.35 32.69 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.159 0.504 . . . . 0.0 111.912 -178.75 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.1 p90 -143.47 157.79 44.17 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.081 -179.739 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 85.1 m-20 64.6 45.46 3.55 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.922 0.391 . . . . 0.0 110.884 -179.41 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.761 ' O ' HD22 ' A' ' 13' ' ' LEU . 68.1 m -69.54 136.29 51.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.777 179.893 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -141.24 150.51 42.73 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.318 -179.951 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.476 ' CG1' HD13 ' A' ' 69' ' ' LEU . 35.2 mt -129.13 138.98 53.05 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 121.301 0.572 . . . . 0.0 111.631 179.93 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -136.27 110.22 8.22 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.245 -0.888 . . . . 0.0 109.374 179.265 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 67.85 -121.09 13.58 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.403 -0.903 . . . . 0.0 110.982 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.408 ' HB3' ' CB ' ' A' ' 5' ' ' ILE . 26.9 p -101.85 -5.7 24.47 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -179.259 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.556 HG13 ' O ' ' A' ' 85' ' ' ILE . 6.5 t -101.03 141.28 17.95 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.075 0.465 . . . . 0.0 111.773 179.693 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.912 HD22 HD22 ' A' ' 37' ' ' LEU . 5.4 tp -103.96 126.63 51.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.565 -179.974 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.586 ' N ' HD12 ' A' ' 69' ' ' LEU . 3.5 m -116.05 125.88 53.03 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.325 -179.956 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.3 t -151.7 153.83 35.14 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.625 0.25 . . . . 0.0 111.336 -179.294 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 82' ' ' THR . 4.2 m -94.08 125.95 39.02 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 178.651 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 93.0 m -124.53 142.89 51.0 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -178.41 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -73.14 137.06 44.93 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.657 178.42 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 60.8 mtp180 -92.29 142.42 27.48 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.574 -0.285 . . . . 0.0 110.632 179.859 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.0 m -52.05 -29.23 20.37 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.572 -0.285 . . . . 0.0 111.476 -179.499 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -82.45 1.27 38.33 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.674 -0.239 . . . . 0.0 111.45 -179.992 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 93.35 135.81 7.61 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.894 -0.67 . . . . 0.0 112.99 179.646 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 116.07 -169.89 13.14 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 -178.622 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -131.27 142.66 50.17 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 117.32 0.56 . . . . 0.0 111.142 -179.899 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -153.84 128.18 9.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.029 -179.697 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 72' ' ' THR . 5.2 t -92.64 134.96 34.5 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.685 -179.028 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 64.1 p -121.33 158.38 28.35 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.375 179.954 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 12.0 m -122.83 144.81 48.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.976 -179.988 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.686 HD11 ' CH2' ' A' ' 50' ' ' TRP . 12.0 tt -144.91 142.83 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.815 -179.818 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -95.3 115.46 27.46 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.93 179.597 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.579 HD23 ' HZ2' ' A' ' 50' ' ' TRP . 14.9 mt -97.01 -5.29 38.06 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -179.343 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.954 ' ND2' HG22 ' A' ' 5' ' ' ILE . 9.0 t-20 -44.42 -28.95 0.62 Allowed 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -178.447 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 64.5 m -82.23 -38.07 25.05 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 -179.749 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . 0.726 HG11 ' CE2' ' A' ' 50' ' ' TRP . 3.1 m -74.09 -52.96 18.59 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 113.471 0.915 . . . . 0.0 113.471 -177.996 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.589 HD12 ' CG2' ' A' ' 90' ' ' VAL . 3.0 mp -82.59 146.41 7.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.032 0.444 . . . . 0.0 111.292 -179.161 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 98' ' ' LEU . 22.1 tt0 -137.38 167.07 22.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.077 -178.851 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -107.18 99.43 8.97 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 121.131 0.491 . . . . 0.0 110.501 -179.745 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.5 t -97.77 95.88 4.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.826 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.9 t0 54.16 33.8 18.75 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.659 0.266 . . . . 0.0 111.549 179.939 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 92.37 28.55 12.76 Favored Glycine 0 CA--C 1.518 0.252 0 C-N-CA 120.559 -0.829 . . . . 0.0 112.97 179.631 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.5 t -139.82 134.25 31.5 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.85 0.357 . . . . 0.0 111.187 -179.597 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.414 ' HA ' ' O ' ' A' ' 92' ' ' GLU . 71.8 mt -73.51 120.09 18.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.57 179.951 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . 0.409 ' O ' ' N ' ' A' ' 92' ' ' GLU . 18.8 mttt -124.93 130.95 53.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.565 -178.927 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.487 ' CG ' ' CE1' ' A' ' 40' ' ' HIS . 26.3 t80 -79.81 -33.6 40.24 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.365 179.636 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.274 -0.869 . . . . 0.0 110.79 179.756 . . . . . . . . 0 0 . 1 stop_ save_