data_2kgj_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 2kgj _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo . . . . . 0 N--CA 1.46 -0.471 0 CA-C-O 121.429 0.512 . . . . 0.0 113.429 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.448 ' HG3' ' HB2' ' A' ' 57' ' ' ASP . 13.1 pt20 -70.74 160.15 33.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.323 172.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.473 ' HB2' ' CG ' ' A' ' 94' ' ' GLN . 99.3 mtt180 -122.59 151.18 41.68 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.995 0.426 . . . . 0.0 111.024 -177.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.642 HG23 HD11 ' A' ' 93' ' ' ILE . 32.2 m -135.19 136.04 41.49 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.516 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.616 ' HD3' ' OD1' ' A' ' 91' ' ' ASP . 63.3 ttt180 -100.84 111.39 23.6 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.779 ' HD2' HD21 ' A' ' 55' ' ' LEU . 19.5 m-85 -106.84 141.06 38.67 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.742 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.478 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 14.7 m -112.84 131.95 55.49 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 169.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.612 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.7 pp -142.59 141.58 27.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 N-CA-C 110.369 -0.234 . . . . 0.0 110.369 -173.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.645 HD11 HG13 ' A' ' 22' ' ' VAL . 10.5 pt -140.42 144.87 26.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -103.37 128.97 50.33 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.924 0.392 . . . . 0.0 110.743 -176.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.699 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 10.9 p -109.0 156.21 20.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.186 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.485 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 71.9 mmtt -65.62 -49.1 69.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.379 -179.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.99 175.61 9.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.557 -177.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.666 ' HG2' ' HD3' ' A' ' 20' ' ' LYS . 26.7 tt0 -63.4 -31.32 72.44 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 176.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -56.62 -45.66 81.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.363 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.699 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 8.4 mm-40 -65.5 -43.01 91.49 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.97 179.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.82 -47.43 85.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.915 178.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.666 ' HD3' ' HG2' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -56.63 -40.85 76.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 175.639 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.92 -37.55 87.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.125 0.488 . . . . 0.0 110.689 177.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.645 HG13 HD11 ' A' ' 11' ' ' ILE . 73.5 t -71.59 -48.23 53.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.371 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.735 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -70.74 -27.85 64.27 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.324 -176.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -61.79 -43.61 98.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.079 0.466 . . . . 0.0 110.16 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.422 ' HG2' HD21 ' A' ' 35' ' ' LEU . 7.5 tp10 -69.66 -46.2 66.68 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.642 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.823 HD13 HD11 ' A' ' 75' ' ' LEU . 3.5 pp -73.0 -13.91 61.32 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.457 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.412 ' N ' HD11 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -66.65 -28.2 68.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.188 0.518 . . . . 0.0 110.125 175.517 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -74.92 -32.19 61.73 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 170.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.14 36.11 13.64 Favored Glycine 0 N--CA 1.444 -0.776 0 CA-C-N 114.555 -1.202 . . . . 0.0 113.24 171.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.79 -64.16 1.26 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 118.877 -1.63 . . . . 0.0 112.741 -178.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -140.31 122.6 15.91 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.904 174.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.609 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 59.3 t80 -84.5 -38.13 20.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.008 0.432 . . . . 0.0 110.232 171.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.58 -38.41 66.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.838 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.492 ' O ' ' HG3' ' A' ' 38' ' ' GLU . . . -64.75 -42.85 94.84 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.504 0.669 . . . . 0.0 110.418 -178.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.461 HD13 ' HA ' ' A' ' 32' ' ' PHE . 9.8 mt -64.07 -36.44 84.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.448 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.568 ' HA ' HG22 ' A' ' 11' ' ' ILE . . . -63.29 -43.85 96.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.309 -1.314 . . . . 0.0 112.174 -176.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.5 -30.17 52.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.945 -173.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 43.6 mt-10 -79.39 -57.81 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -170.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.621 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -99.32 -26.44 14.16 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.655 0.74 . . . . 0.0 112.276 -171.266 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.57 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 37.1 t -67.65 137.56 55.68 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -170.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.25 1.03 38.61 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.662 171.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.555 ' HB3' ' HG ' ' A' ' 40' ' ' SER . 24.9 t70 -69.85 -14.87 62.96 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.952 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.917 ' HA ' ' HB2' ' A' ' 46' ' ' ALA . 2.3 pp -54.6 -14.72 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -155.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.819 HD13 ' H ' ' A' ' 44' ' ' ILE . 3.6 mp -51.18 -37.9 18.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 167.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.8 m -109.92 -32.93 6.87 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.816 174.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.917 ' HB2' ' HA ' ' A' ' 43' ' ' ILE . . . -54.58 -29.26 50.95 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.555 ' HG3' ' O ' ' A' ' 43' ' ' ILE . 80.4 mtp180 -59.34 -15.1 14.24 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 117.718 0.236 . . . . 0.0 111.44 178.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -83.69 9.64 11.2 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.974 0.416 . . . . 0.0 110.536 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.1 26.17 22.35 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 111.605 -0.598 . . . . 0.0 111.605 -176.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 83.64 -8.06 66.97 Favored Glycine 0 C--N 1.329 0.181 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -73.26 116.22 13.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.889 0.376 . . . . 0.0 111.184 -177.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.576 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 26.0 ptm -82.24 -19.38 39.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.697 176.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 118.24 177.0 17.0 Favored Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.957 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.565 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 72.2 m95 -84.37 114.68 22.05 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.682 0.277 . . . . 0.0 110.781 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.779 HD21 ' HD2' ' A' ' 8' ' ' TYR . 3.1 pp -98.01 155.72 16.97 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.594 175.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.418 ' HG2' ' HG2' ' A' ' 5' ' ' ARG . 35.5 mt-10 -96.63 145.33 25.85 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.448 ' HB2' ' HG3' ' A' ' 4' ' ' GLN . 13.8 t70 -65.13 141.2 58.78 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -176.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 72.14 9.22 5.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.335 -177.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 15.8 p -110.45 -0.1 17.6 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 167.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.65 HG12 HD12 ' A' ' 55' ' ' LEU . 25.0 mt -71.55 129.87 88.09 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.945 -176.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . 0.424 ' HG2' HD11 ' A' ' 64' ' ' LEU . 30.1 Cg_endo -65.03 148.89 89.82 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.487 2.125 . . . . 0.0 111.169 173.042 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.693 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 0.8 OUTLIER -56.43 -25.24 49.75 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.462 -175.121 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.21 -49.74 75.05 Favored 'General case' 0 C--N 1.319 -0.743 0 O-C-N 123.41 0.444 . . . . 0.0 110.51 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.424 HD11 ' HG2' ' A' ' 61' ' ' PRO . 6.0 mp -83.42 -15.29 50.27 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.693 ' HD2' ' HA ' ' A' ' 62' ' ' ASP . 97.3 mttt -61.48 -31.97 71.97 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.449 0.642 . . . . 0.0 109.879 174.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -83.53 -5.37 59.15 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.6 -178.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.799 ' HB2' HG13 ' A' ' 88' ' ' VAL . . . -69.08 -32.01 71.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.007 0.432 . . . . 0.0 111.598 -178.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 70.19 17.7 74.23 Favored Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.477 174.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.703 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 15.3 mt -91.68 84.49 5.46 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -176.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' A' ' 70' ' ' LYS . 40.4 mmtm -102.73 -22.77 13.88 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 174.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -94.07 120.24 34.05 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.475 0.178 . . . . 0.0 111.157 -178.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.6 tttp -66.42 130.15 42.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.039 0.447 . . . . 0.0 111.452 -171.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.27 -12.49 40.19 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 111.224 -0.751 . . . . 0.0 111.224 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -78.23 122.29 25.5 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.106 0.479 . . . . 0.0 110.227 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.823 HD11 HD13 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -133.01 169.59 16.61 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.525 -179.673 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.695 ' HB2' HD12 ' A' ' 26' ' ' LEU . 23.1 t 77.99 53.24 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 124.178 0.924 . . . . 0.0 110.297 -174.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -101.11 108.77 3.5 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 110.227 -1.149 . . . . 0.0 110.227 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.2 t -99.17 113.72 34.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.144 0.497 . . . . 0.0 109.972 -176.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.484 HD13 HD23 ' A' ' 86' ' ' LEU . 69.2 mt -98.93 115.29 39.09 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.071 -178.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.561 ' HG2' ' HE2' ' A' ' 85' ' ' PHE . 1.5 tmtp? -81.19 113.66 19.49 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.905 -175.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.0 t -125.78 160.84 28.76 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 12.2 t -74.4 -26.28 59.99 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.156 0.503 . . . . 0.0 109.893 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 25.8 m -79.65 -10.12 12.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.988 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.16 -163.99 27.32 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 111.099 -0.8 . . . . 0.0 111.099 -178.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.561 ' HE2' ' HG2' ' A' ' 80' ' ' LYS . 96.7 m-85 -116.39 129.53 56.29 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.061 0.458 . . . . 0.0 110.892 -176.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.607 HD11 ' HB ' ' A' ' 10' ' ' ILE . 48.4 tp -103.93 135.06 46.16 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.875 -178.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.612 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 22.4 mm -107.64 121.4 60.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.799 HG13 ' HB2' ' A' ' 67' ' ' ALA . 14.8 p -110.5 137.48 42.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 CA-C-O 121.206 0.527 . . . . 0.0 111.024 -176.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.747 ' HG3' ' HB3' ' A' ' 75' ' ' LEU . 7.0 ttp180 -132.14 144.61 50.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.975 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.703 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 10.6 mt -93.22 110.47 21.98 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.359 177.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.616 ' OD1' ' HD3' ' A' ' 7' ' ' ARG . 17.5 t70 -79.06 -54.33 6.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.812 177.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.565 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 6.5 t70 -156.17 165.91 35.0 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.713 0.292 . . . . 0.0 111.529 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.642 HD11 HG23 ' A' ' 6' ' ' THR . 32.9 mm -130.81 128.98 63.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.778 -0.647 . . . . 0.0 109.409 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.473 ' CG ' ' HB2' ' A' ' 5' ' ' ARG . 10.5 pt20 . . . . . 0 C--N 1.327 -0.4 0 CA-C-O 121.078 0.466 . . . . 0.0 110.375 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 N--CA 1.454 -0.829 0 CA-C-O 121.006 0.336 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.573 ' HG3' ' HB3' ' A' ' 57' ' ' ASP . 13.8 pt20 -70.35 158.83 35.24 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 175.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.492 ' HG2' ' HA ' ' A' ' 56' ' ' GLU . 99.4 mtt180 -128.28 148.28 50.64 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.305 0.574 . . . . 0.0 111.596 -170.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.606 HG23 HD13 ' A' ' 93' ' ' ILE . 69.8 m -123.16 136.13 54.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.518 -177.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.417 ' HB2' ' CE2' ' A' ' 54' ' ' TRP . 68.5 ttt180 -99.93 111.69 23.99 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.746 ' HD2' HD22 ' A' ' 55' ' ' LEU . 12.4 m-85 -104.61 138.33 41.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.366 0.603 . . . . 0.0 111.549 -178.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.71 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 19.4 m -111.56 133.41 53.85 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 170.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.661 ' HB ' HD13 ' A' ' 86' ' ' LEU . 2.8 pp -142.33 145.68 23.35 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.04 -174.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.664 HG12 ' HB ' ' A' ' 87' ' ' ILE . 3.3 pt -139.75 148.18 23.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -99.65 112.63 24.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.914 0.387 . . . . 0.0 110.667 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 21.7 p -96.12 144.84 26.0 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.186 176.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -84.88 -21.36 29.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.997 -169.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.489 ' O ' ' HB2' ' A' ' 18' ' ' GLU . 4.1 m -147.65 164.57 33.11 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.569 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 26.9 tt0 -69.71 -27.28 64.86 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.17 -39.47 82.61 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.477 172.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.605 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 5.8 mm-40 -64.23 -41.09 97.16 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.935 -1.029 . . . . 0.0 110.165 175.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.57 ' O ' ' HG ' ' A' ' 23' ' ' LEU . . . -63.18 -47.29 83.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.669 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 16' ' ' GLU . 74.4 mmtt -55.01 -44.11 74.25 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.156 0.503 . . . . 0.0 110.789 178.132 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.99 -37.07 72.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.151 -179.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.6 HG23 ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -76.2 -38.38 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.745 -175.416 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 19' ' ' ALA . 4.2 pp -72.61 -28.42 62.77 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 121.104 -0.239 . . . . 0.0 111.279 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.518 ' N ' HD13 ' A' ' 23' ' ' LEU . 30.3 t70 -58.01 -41.12 82.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.674 0.274 . . . . 0.0 111.553 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.647 ' HB3' HD22 ' A' ' 35' ' ' LEU . 0.7 OUTLIER -71.37 -44.04 65.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.104 0.478 . . . . 0.0 109.855 -179.367 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.586 ' HB3' ' CD1' ' A' ' 35' ' ' LEU . 3.8 pp -73.16 -16.94 61.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.674 -178.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.89 -25.01 60.92 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.235 0.54 . . . . 0.0 109.667 172.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -84.96 -24.55 28.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.918 0.866 . . . . 0.0 108.784 170.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.03 39.91 36.45 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 114.104 -1.407 . . . . 0.0 112.486 175.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.47 -64.46 1.44 Allowed Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 118.526 -1.797 . . . . 0.0 112.512 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.477 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 45.3 t0 -141.8 114.98 8.79 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 117.142 0.471 . . . . 0.0 111.127 170.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.621 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 32.8 t80 -77.47 -31.98 54.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.107 0.48 . . . . 0.0 109.747 173.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.489 ' HB2' ' HA2' ' A' ' 49' ' ' GLY . . . -64.62 -31.64 72.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.712 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.65 -40.85 84.52 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.357 0.599 . . . . 0.0 109.944 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.647 HD22 ' HB3' ' A' ' 25' ' ' GLU . 14.0 mt -62.25 -44.89 95.51 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.458 178.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.603 ' HB1' ' HB1' ' A' ' 46' ' ' ALA . . . -56.99 -47.48 80.69 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.592 -1.185 . . . . 0.0 111.529 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.507 ' HG2' ' HA ' ' A' ' 47' ' ' ARG . 39.4 mtpt -79.89 -32.99 40.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.153 -172.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -80.36 -60.7 2.22 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -169.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.605 ' HD3' ' HB3' ' A' ' 18' ' ' GLU . 1.1 ttmm -103.11 -25.05 13.54 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.984 0.897 . . . . 0.0 112.813 -170.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.534 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 7.5 m -75.31 143.34 42.98 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.519 -169.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -79.19 1.61 23.96 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.611 0.719 . . . . 0.0 110.24 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.561 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 27.8 t70 -65.82 -16.65 64.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.395 176.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.861 ' HA ' ' HB2' ' A' ' 46' ' ' ALA . 3.5 pt -56.21 -17.88 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 114.579 1.325 . . . . 0.0 114.579 -157.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 71.0 mt -51.74 -39.8 25.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.268 0.556 . . . . 0.0 110.014 167.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 35.4 t -112.41 -28.96 7.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.345 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.861 ' HB2' ' HA ' ' A' ' 43' ' ' ILE . . . -51.71 -29.36 18.09 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -175.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.507 ' HA ' ' HG2' ' A' ' 37' ' ' LYS . 89.8 mtt180 -63.71 -8.84 11.44 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.8 p30 -90.38 10.32 25.49 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.958 0.409 . . . . 0.0 110.991 170.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.489 ' HA2' ' HB2' ' A' ' 33' ' ' ALA . . . 92.26 26.51 18.24 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 116.141 -0.482 . . . . 0.0 112.976 -176.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.42 20.06 79.79 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 121.62 -0.324 . . . . 0.0 113.364 173.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -97.0 122.94 40.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.014 0.435 . . . . 0.0 111.033 -176.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.538 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 27.0 ptm -82.68 -19.67 37.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.834 176.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 113.69 -171.22 13.69 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.0 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.537 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 84.4 m95 -90.68 125.47 35.67 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.004 0.43 . . . . 0.0 111.143 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.746 HD22 ' HD2' ' A' ' 8' ' ' TYR . 2.7 pp -115.33 156.51 25.36 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 173.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.525 ' O ' ' HB ' ' A' ' 59' ' ' THR . 25.3 mt-10 -81.67 132.26 35.29 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.964 0.412 . . . . 0.0 110.092 -177.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.573 ' HB3' ' HG3' ' A' ' 4' ' ' GLN . 31.9 t70 -73.22 145.32 46.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.277 -175.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 62.9 7.56 2.69 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.422 -172.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.525 ' HB ' ' O ' ' A' ' 56' ' ' GLU . 13.6 m -112.11 3.01 17.03 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.694 HG12 HD13 ' A' ' 55' ' ' LEU . 21.8 mt -73.59 133.59 79.88 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 113.835 -1.53 . . . . 0.0 110.865 -173.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.75 155.61 53.11 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.801 2.334 . . . . 0.0 111.839 174.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.667 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 8.9 m-20 -55.54 -27.51 49.31 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.048 -0.978 . . . . 0.0 112.708 -171.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.97 -55.49 32.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.936 178.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.497 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 5.2 mp -83.45 -16.59 45.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.532 -177.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.667 ' HD2' ' HA ' ' A' ' 62' ' ' ASP . 67.6 mttm -56.86 -44.12 81.85 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.602 0.715 . . . . 0.0 109.602 172.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -75.67 -5.34 45.09 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.017 -176.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.833 ' HB3' HG11 ' A' ' 88' ' ' VAL . . . -71.33 -31.09 66.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.037 0.446 . . . . 0.0 111.049 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 77.48 19.08 76.92 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.935 175.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.693 HD13 HG22 ' A' ' 88' ' ' VAL . 11.8 mt -96.11 87.26 4.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.839 0.352 . . . . 0.0 111.309 -177.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -100.69 -41.44 6.91 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -177.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.498 ' O ' HD13 ' A' ' 90' ' ' LEU . 31.5 tt0 -100.32 135.33 41.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.853 0.358 . . . . 0.0 111.351 -174.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.472 ' HE3' ' O ' ' A' ' 91' ' ' ASP . 1.6 tmtp? -66.48 135.39 54.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.522 -170.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.58 -11.96 39.08 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.495 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.505 ' HB3' HD11 ' A' ' 90' ' ' LEU . 10.1 tt0 -83.9 127.8 34.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.159 0.504 . . . . 0.0 110.705 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.551 ' HB3' ' HG2' ' A' ' 89' ' ' ARG . 1.4 pp -138.27 170.3 16.27 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.345 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.9 t 78.64 60.37 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 124.106 0.879 . . . . 0.0 111.093 -178.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -110.88 120.31 5.49 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 170.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 25.8 t -107.91 113.51 43.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.216 0.531 . . . . 0.0 110.346 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.472 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 43.9 mm -103.84 118.12 50.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.249 -178.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.445 ' HG3' ' CE2' ' A' ' 85' ' ' PHE . 86.4 tttt -82.87 130.32 35.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.402 0.62 . . . . 0.0 111.164 -178.081 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.3 m -126.96 166.92 16.62 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.041 173.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.3 m -79.04 -26.02 43.16 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.496 0.665 . . . . 0.0 109.337 177.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 33.6 m -85.47 -5.84 10.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.531 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.25 -157.24 27.12 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.884 -0.675 . . . . 0.0 111.851 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.526 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 83.1 m-85 -124.85 136.55 53.91 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 117.035 0.417 . . . . 0.0 110.333 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.661 HD13 ' HB ' ' A' ' 10' ' ' ILE . 57.1 tp -107.78 135.49 49.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.775 0.321 . . . . 0.0 110.382 -178.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.664 ' HB ' HG12 ' A' ' 11' ' ' ILE . 24.9 mm -108.95 127.55 65.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.833 HG11 ' HB3' ' A' ' 67' ' ' ALA . 11.1 p -112.78 141.01 29.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.268 0.556 . . . . 0.0 110.542 -176.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.71 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 1.5 tmm_? -142.16 130.92 22.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.879 -174.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.668 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.8 mt -87.4 109.68 19.74 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 120.702 0.287 . . . . 0.0 111.31 178.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.472 ' O ' ' HE3' ' A' ' 72' ' ' LYS . 11.9 t70 -79.42 -53.92 6.43 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.662 177.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.537 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 28.7 t0 -156.0 164.52 38.35 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.932 -0.307 . . . . 0.0 111.781 -178.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.606 HD13 HG23 ' A' ' 6' ' ' THR . 26.6 mm -134.65 123.84 42.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.125 176.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.508 ' HG2' ' CZ3' ' A' ' 54' ' ' TRP . 28.9 pt20 . . . . . 0 C--N 1.327 -0.387 0 CA-C-O 121.025 0.441 . . . . 0.0 110.603 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo . . . . . 0 N--CA 1.459 -0.523 0 CA-C-O 121.211 0.421 . . . . 0.0 112.891 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -75.59 158.65 32.18 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.132 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.487 ' HE ' ' HG2' ' A' ' 56' ' ' GLU . 99.7 mtt180 -121.85 145.73 47.79 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.437 0.637 . . . . 0.0 112.11 -171.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 26.1 m -135.09 141.22 46.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.384 -176.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.574 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 57.3 ttt180 -100.4 111.91 24.22 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 177.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.485 ' HE1' ' HB3' ' A' ' 69' ' ' LEU . 23.1 m-85 -106.67 139.67 40.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.154 0.502 . . . . 0.0 111.569 -178.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.8 m -117.49 132.38 56.56 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 171.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.722 ' HB ' HD23 ' A' ' 86' ' ' LEU . 2.7 pp -140.69 145.31 25.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -174.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.609 HG22 ' HA ' ' A' ' 36' ' ' ALA . 7.3 pt -140.46 138.56 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -98.13 118.32 34.48 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.986 0.422 . . . . 0.0 110.163 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.708 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 52.7 p -94.34 149.65 21.03 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.246 174.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.545 ' HB2' ' OE2' ' A' ' 18' ' ' GLU . 25.2 mttp -77.75 -25.47 49.21 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.497 -173.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -141.97 168.25 20.2 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.357 176.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.435 ' HB2' ' CZ ' ' A' ' 85' ' ' PHE . 23.9 tt0 -64.68 -32.95 74.84 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -53.71 -41.68 67.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.632 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.708 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 49.9 mt-10 -69.68 -41.31 75.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.384 178.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.548 ' HA ' HD13 ' A' ' 87' ' ' ILE . . . -59.41 -39.1 82.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.405 178.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -55.32 -50.91 68.39 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.812 0.339 . . . . 0.0 110.775 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.21 -30.87 70.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.08 -177.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.792 HG22 ' HE3' ' A' ' 39' ' ' LYS . 21.9 t -75.51 -52.2 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.899 -0.592 . . . . 0.0 109.806 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.462 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -66.48 -28.45 68.59 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.051 -176.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.412 ' N ' HD13 ' A' ' 23' ' ' LEU . 17.8 t70 -64.24 -44.2 92.56 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.025 0.441 . . . . 0.0 110.369 175.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -75.53 -45.45 38.01 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.98 -175.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.782 HD13 HD11 ' A' ' 75' ' ' LEU . 3.1 pp -72.55 -14.93 61.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.746 0.308 . . . . 0.0 110.984 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.477 ' N ' HD11 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -63.01 -27.69 69.59 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 174.009 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.03 -25.62 17.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.767 0.794 . . . . 0.0 109.373 173.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.45 45.63 13.75 Favored Glycine 0 N--CA 1.448 -0.514 0 CA-C-N 114.597 -1.183 . . . . 0.0 113.879 168.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.28 -64.26 1.66 Allowed Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 118.706 -1.711 . . . . 0.0 112.593 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.514 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 45.3 t0 -141.1 115.91 9.71 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 117.109 0.454 . . . . 0.0 111.474 171.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.46 ' HA ' HD13 ' A' ' 35' ' ' LEU . 60.8 t80 -77.19 -33.14 56.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.817 0.342 . . . . 0.0 110.374 174.466 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.3 -30.34 71.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.815 -177.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.6 -42.21 71.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.425 0.631 . . . . 0.0 109.552 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 31' ' ' ASP . 13.0 mt -61.28 -45.05 96.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.1 -0.954 . . . . 0.0 109.258 176.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.609 ' HA ' HG22 ' A' ' 11' ' ' ILE . . . -56.19 -51.05 69.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.31 -1.314 . . . . 0.0 112.244 -176.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.649 ' HG2' ' HA ' ' A' ' 47' ' ' ARG . 54.0 mtpt -78.21 -22.65 48.2 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.782 -170.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -80.09 -59.8 2.58 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.792 ' HE3' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -103.33 -22.88 13.63 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -171.834 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.404 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 0.7 OUTLIER -75.18 147.67 40.23 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.413 -163.704 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.15 4.12 24.49 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.826 0.822 . . . . 0.0 109.651 174.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.773 ' HB3' ' HB3' ' A' ' 46' ' ' ALA . 14.6 t70 -68.92 -15.05 63.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.383 -1.281 . . . . 0.0 112.146 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.898 ' HA ' ' HB2' ' A' ' 46' ' ' ALA . 2.4 pp -54.81 -14.97 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -153.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.799 ' H ' HD11 ' A' ' 44' ' ' ILE . 4.1 mp -51.62 -40.48 25.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 166.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.7 p -120.04 -6.16 9.99 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.675 177.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.898 ' HB2' ' HA ' ' A' ' 43' ' ' ILE . . . -71.39 -29.88 65.45 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.923 -0.486 . . . . 0.0 111.091 179.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.649 ' HA ' ' HG2' ' A' ' 37' ' ' LYS . 79.7 mtp180 -59.09 -28.58 66.63 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.668 -177.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -90.09 13.24 15.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.131 0.491 . . . . 0.0 110.903 176.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.59 21.87 30.43 Favored Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.959 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.37 11.34 76.02 Favored Glycine 0 C--N 1.327 0.062 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.185 175.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -76.3 115.76 16.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.341 -0.429 . . . . 0.0 110.781 -178.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.514 ' SD ' HG12 ' A' ' 10' ' ' ILE . 88.1 mtp -79.6 -20.94 45.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.319 0.58 . . . . 0.0 109.606 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 107.83 -162.17 13.3 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.046 -177.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -95.55 119.26 33.74 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.904 0.383 . . . . 0.0 110.811 178.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.426 ' N ' HD13 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -108.7 155.85 20.25 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.193 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.487 ' HG2' ' HE ' ' A' ' 5' ' ' ARG . 40.2 mt-10 -93.99 131.07 39.82 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.532 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -61.53 148.94 40.45 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.402 -174.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 63.87 6.77 2.9 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.711 -174.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 5.1 m -112.18 -0.74 15.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 122.24 1.019 . . . . 0.0 108.764 168.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.642 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 24.3 mt -75.2 137.61 72.07 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.524 -175.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . 0.5 ' HG2' HD12 ' A' ' 64' ' ' LEU . 18.8 Cg_endo -61.37 146.12 97.54 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.345 2.03 . . . . 0.0 111.244 174.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.65 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 7.8 p-10 -56.59 -24.0 44.53 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.251 -172.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -57.64 -49.03 77.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.356 0.41 . . . . 0.0 110.802 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.5 HD12 ' HG2' ' A' ' 61' ' ' PRO . 6.4 mp -83.1 -15.34 51.23 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.317 -178.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.65 ' HD2' ' HA ' ' A' ' 62' ' ' ASP . 94.2 mttt -64.08 -34.32 77.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.584 0.707 . . . . 0.0 110.089 174.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -71.8 -5.72 36.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.527 -178.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.58 ' HB1' HD13 ' A' ' 69' ' ' LEU . . . -70.85 -39.16 73.12 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.088 0.47 . . . . 0.0 111.227 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 72.13 15.4 76.62 Favored Glycine 0 C--N 1.332 0.345 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.132 -174.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.607 ' C ' HD13 ' A' ' 90' ' ' LEU . 6.7 mp -81.33 78.69 8.09 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -174.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 70.7 mmtt -102.44 -16.62 16.12 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 175.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -109.08 125.52 52.22 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 122.214 -0.304 . . . . 0.0 111.278 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.796 ' HB2' HD13 ' A' ' 93' ' ' ILE . 87.5 tttt -66.11 133.4 50.65 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.22 0.533 . . . . 0.0 112.139 -169.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 101.58 -3.88 53.73 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.253 -177.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.62 ' HB3' HD12 ' A' ' 90' ' ' LEU . 10.2 tt0 -80.44 114.43 19.34 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 121.31 0.576 . . . . 0.0 109.722 175.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.782 HD11 HD13 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -133.64 169.78 16.52 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.911 178.8 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.599 ' HB2' HD12 ' A' ' 26' ' ' LEU . 18.5 t 78.56 46.2 0.05 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 122.007 0.908 . . . . 0.0 110.358 -174.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -96.96 103.74 2.95 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 167.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 17.7 t -103.09 113.13 38.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -174.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 59.9 mt -94.1 109.43 22.03 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.602 -177.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.437 ' HD2' ' HE2' ' A' ' 85' ' ' PHE . 26.0 tttt -75.28 113.69 12.95 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.391 -174.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' SER . . . . . 0.56 ' HB2' ' O ' ' A' ' 84' ' ' GLY . 14.9 m -126.75 137.87 53.3 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.403 -1.271 . . . . 0.0 107.936 173.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.8 p -62.47 -26.02 68.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.352 -175.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 19.9 m -79.59 -19.4 12.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.297 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . 0.56 ' O ' ' HB2' ' A' ' 81' ' ' SER . . . 161.08 163.59 14.38 Favored Glycine 0 N--CA 1.444 -0.787 0 N-CA-C 111.006 -0.837 . . . . 0.0 111.006 -175.045 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.437 ' HE2' ' HD2' ' A' ' 80' ' ' LYS . 57.8 m-85 -109.6 127.96 54.88 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 120.77 0.319 . . . . 0.0 110.798 -172.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.722 HD23 ' HB ' ' A' ' 10' ' ' ILE . 1.2 tt -111.16 138.49 47.54 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 121.545 0.688 . . . . 0.0 110.666 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.548 HD13 ' HA ' ' A' ' 19' ' ' ALA . 6.5 mt -117.46 121.37 67.42 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 CA-C-N 114.557 -1.202 . . . . 0.0 110.588 -175.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.472 HG23 HD22 ' A' ' 69' ' ' LEU . 7.1 p -113.06 141.38 28.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.667 -176.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.701 ' HB2' ' HB3' ' A' ' 75' ' ' LEU . 2.8 ptm180 -138.45 158.31 44.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.449 0.642 . . . . 0.0 110.72 174.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.837 HD21 HD12 ' A' ' 93' ' ' ILE . 12.9 mt -96.57 109.6 22.17 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.207 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.574 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 21.7 t70 -79.56 -53.91 6.41 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.052 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.474 ' C ' HD11 ' A' ' 93' ' ' ILE . 43.2 t0 -155.03 160.57 41.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.741 -177.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.837 HD12 HD21 ' A' ' 90' ' ' LEU . 1.7 mp -128.87 136.05 60.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.092 -0.503 . . . . 0.0 109.879 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 . . . . . 0 C--N 1.331 -0.217 0 CA-C-O 120.871 0.367 . . . . 0.0 111.322 178.645 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo . . . . . 0 N--CA 1.446 -1.305 0 CA-C-O 121.054 0.356 . . . . 0.0 111.482 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.572 ' HG3' ' HB3' ' A' ' 57' ' ' ASP . 12.7 pt20 -80.74 158.8 25.39 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.639 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 49.6 mtt180 -128.99 151.21 49.93 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.08 0.467 . . . . 0.0 111.51 -171.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.9 m -128.62 131.12 48.08 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.717 176.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.528 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 58.8 ttt180 -95.61 111.74 23.61 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.68 -0.408 . . . . 0.0 109.9 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.65 ' HD2' HD22 ' A' ' 55' ' ' LEU . 22.4 m-85 -106.43 146.47 30.47 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.481 0.658 . . . . 0.0 111.131 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.43 ' HB2' ' HE ' ' A' ' 89' ' ' ARG . 16.2 m -125.86 132.52 52.17 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 169.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.663 ' HB ' HD13 ' A' ' 86' ' ' LEU . 2.9 pp -136.67 149.14 26.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 -175.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.618 HD12 HG13 ' A' ' 22' ' ' VAL . 5.3 pt -140.32 147.59 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 177.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -103.99 121.32 42.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.386 -176.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.753 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 73.8 p -97.86 153.76 18.1 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.61 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -84.9 -25.57 27.85 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.219 -175.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.0 m -149.9 165.24 33.19 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 176.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.668 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 30.6 tt0 -56.12 -39.34 72.07 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.047 0.451 . . . . 0.0 110.384 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -57.53 -38.6 74.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.918 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.951 ' HB3' ' HD2' ' A' ' 39' ' ' LYS . 10.9 mm-40 -64.89 -36.28 83.85 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.82 -176.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.615 ' HA ' HD12 ' A' ' 87' ' ' ILE . . . -70.69 -38.61 73.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.595 178.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.668 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.0 mmtp -58.51 -43.66 89.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.308 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.06 -34.27 77.64 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.817 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.618 HG13 HD12 ' A' ' 11' ' ' ILE . 92.1 t -73.52 -49.25 37.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.331 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.686 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.5 pp -65.72 -28.54 69.13 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.215 -176.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.447 ' N ' HD13 ' A' ' 23' ' ' LEU . 19.2 t70 -63.8 -46.47 85.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.097 0.475 . . . . 0.0 110.412 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -75.07 -38.85 61.18 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.854 -175.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 1.102 HD13 ' HB3' ' A' ' 76' ' ' SER . 2.7 pp -72.71 -17.09 61.66 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.153 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.497 ' N ' HD12 ' A' ' 26' ' ' LEU . 2.0 m-80 -69.35 -21.16 63.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.121 0.486 . . . . 0.0 110.139 175.111 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -77.63 -26.2 50.36 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 172.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.13 31.32 52.96 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-N 114.486 -1.234 . . . . 0.0 112.627 173.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -91.2 -64.11 1.18 Allowed Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 118.758 -1.687 . . . . 0.0 113.301 -177.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.458 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 8.0 t0 -140.1 115.47 9.94 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 122.76 -0.259 . . . . 0.0 111.351 177.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.468 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 93.1 t80 -85.4 -41.31 15.55 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.96 0.41 . . . . 0.0 110.893 172.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.74 -33.81 61.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.259 -178.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.32 -44.52 75.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.311 178.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 31' ' ' ASP . 12.4 mt -60.57 -38.36 84.33 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.636 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.531 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -59.53 -50.93 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.502 179.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -69.61 -35.33 75.17 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.921 -173.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.49 -55.48 5.18 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -175.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.951 ' HD2' ' HB3' ' A' ' 18' ' ' GLU . 1.0 OUTLIER -96.73 -24.04 16.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.701 0.762 . . . . 0.0 112.869 -166.373 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.614 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 29.0 t -93.44 147.38 23.01 Favored 'General case' 0 C--N 1.291 -1.94 0 O-C-N 121.514 -0.741 . . . . 0.0 112.93 -167.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.53 0.62 41.76 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.11 174.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.689 ' HB3' ' HB3' ' A' ' 46' ' ' ALA . 31.4 t70 -59.87 -14.69 16.44 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.46 -1.246 . . . . 0.0 112.666 178.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.927 ' HA ' ' HB2' ' A' ' 46' ' ' ALA . 2.5 pp -54.73 -14.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -152.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.431 ' N ' HD13 ' A' ' 43' ' ' ILE . 44.3 mm -51.82 -33.04 15.19 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 CA-C-O 121.378 0.608 . . . . 0.0 109.539 165.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.8 m -119.62 -20.39 7.73 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.212 174.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.927 ' HB2' ' HA ' ' A' ' 43' ' ' ILE . . . -64.32 -29.98 71.04 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 121.84 -0.537 . . . . 0.0 111.767 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -57.15 -34.28 68.25 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.603 0.239 . . . . 0.0 111.521 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -88.71 13.87 11.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.233 0.54 . . . . 0.0 110.934 176.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.78 24.66 22.6 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.342 -0.844 . . . . 0.0 113.049 178.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.02 14.2 76.1 Favored Glycine 0 CA--C 1.51 -0.254 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.129 174.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -85.58 115.8 23.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.897 0.379 . . . . 0.0 110.311 -176.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.415 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 26.1 ptm -80.64 -19.62 44.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.118 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 115.02 -166.61 12.18 Favored Glycine 0 N--CA 1.439 -1.128 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.737 -178.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.776 ' CZ3' ' HB2' ' A' ' 94' ' ' GLN . 82.4 m95 -98.85 113.37 25.46 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.914 0.387 . . . . 0.0 111.081 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.713 HD11 HG12 ' A' ' 60' ' ' ILE . 2.6 pp -99.64 153.31 19.17 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.372 173.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -84.92 132.72 34.34 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.572 ' HB3' ' HG3' ' A' ' 4' ' ' GLN . 23.8 t70 -67.56 145.39 54.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.292 -175.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 65.4 7.13 4.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.903 -173.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.404 ' H ' ' C ' ' A' ' 57' ' ' ASP . 4.8 m -112.72 9.32 19.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 122.032 0.92 . . . . 0.0 108.828 166.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.713 HG12 HD11 ' A' ' 55' ' ' LEU . 6.0 mt -81.94 137.79 46.64 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.705 -172.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.27 152.36 72.77 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.742 2.295 . . . . 0.0 111.582 176.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.03 -25.26 66.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.77 -168.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.536 ' HA ' ' ND2' ' A' ' 66' ' ' ASN . 41.1 tt0 -70.01 -25.88 63.8 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.377 0.608 . . . . 0.0 110.257 177.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.582 ' HB2' HG21 ' A' ' 60' ' ' ILE . 4.4 mm? -80.93 -22.85 39.33 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.116 176.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -72.97 -44.75 60.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.541 178.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.536 ' ND2' ' HA ' ' A' ' 63' ' ' GLU . 5.0 p30 -74.46 -6.06 46.14 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.967 0.413 . . . . 0.0 110.435 -177.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.938 ' HB2' HG12 ' A' ' 88' ' ' VAL . . . -62.83 -32.22 73.38 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.402 173.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.22 26.82 54.28 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.889 175.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.662 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 10.3 mt -102.64 86.88 2.85 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.839 0.352 . . . . 0.0 111.714 -176.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -101.25 -41.9 6.53 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.671 176.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -94.18 127.87 40.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.92 0.391 . . . . 0.0 111.825 -175.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.832 ' HE2' ' HA ' ' A' ' 92' ' ' ASP . 51.0 tttm -66.71 133.77 50.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.267 -172.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.04 -8.41 38.79 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.25 -0.74 . . . . 0.0 111.25 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -86.93 128.09 35.06 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.143 0.497 . . . . 0.0 109.996 178.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.684 HD13 ' HB2' ' A' ' 26' ' ' LEU . 2.2 pt? -144.62 169.9 17.1 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.823 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 1.102 ' HB3' HD13 ' A' ' 26' ' ' LEU . 57.4 p 78.1 45.79 0.06 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.476 1.51 . . . . 0.0 111.266 -171.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -91.56 103.98 3.11 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 168.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 16.8 t -97.96 113.6 33.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.172 0.51 . . . . 0.0 109.855 -174.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.579 HD12 ' HA ' ' A' ' 67' ' ' ALA . 49.9 mm -103.99 124.07 58.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.439 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -82.56 126.23 32.04 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.132 0.491 . . . . 0.0 110.51 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.7 t -129.53 158.84 38.13 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 175.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.5 p -66.37 -25.84 66.98 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.958 0.409 . . . . 0.0 110.764 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 34.9 m -83.27 -11.36 11.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.423 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.95 -161.39 27.82 Favored Glycine 0 C--O 1.226 -0.366 0 N-CA-C 111.502 -0.639 . . . . 0.0 111.502 -177.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.584 ' HB2' ' OG1' ' A' ' 13' ' ' THR . 95.3 m-85 -111.14 138.68 47.27 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 117.334 0.567 . . . . 0.0 110.842 -178.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.663 HD13 ' HB ' ' A' ' 10' ' ' ILE . 36.2 tp -114.53 135.71 53.82 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.944 -177.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.615 HD12 ' HA ' ' A' ' 19' ' ' ALA . 15.7 mt -113.23 121.21 65.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.306 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.938 HG12 ' HB2' ' A' ' 67' ' ' ALA . 14.8 p -106.28 140.42 24.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.071 -175.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.468 ' HD3' ' CG ' ' A' ' 32' ' ' PHE . 15.3 ttp85 -132.23 141.79 49.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.792 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.662 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.0 mt -94.55 108.83 20.77 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.448 175.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.528 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 22.6 t70 -80.62 -54.98 5.17 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.098 -0.641 . . . . 0.0 111.815 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.832 ' HA ' ' HE2' ' A' ' 72' ' ' LYS . 9.1 t70 -156.63 170.13 23.1 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.165 -174.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.408 HG12 ' HB2' ' A' ' 72' ' ' LYS . 45.5 mm -127.59 120.05 53.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.776 ' HB2' ' CZ3' ' A' ' 54' ' ' TRP . 6.9 tt0 . . . . . 0 C--N 1.326 -0.435 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -169.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo . . . . . 0 N--CA 1.457 -0.647 0 CA-C-O 120.925 0.302 . . . . 0.0 112.11 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -70.31 158.46 35.88 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.618 ' HE ' ' HG2' ' A' ' 56' ' ' GLU . 99.1 mtt180 -122.31 135.39 54.72 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.47 0.652 . . . . 0.0 111.741 -173.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.604 HG22 HD12 ' A' ' 93' ' ' ILE . 32.0 m -120.46 137.42 54.35 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.205 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.537 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 62.8 ttt180 -96.25 110.88 23.1 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 177.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.685 ' HD2' HD21 ' A' ' 55' ' ' LEU . 19.2 m-85 -109.27 137.59 46.92 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.144 0.497 . . . . 0.0 111.328 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.682 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 15.3 m -109.8 132.31 54.27 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.464 -0.789 . . . . 0.0 108.913 169.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.707 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.9 pp -142.73 143.82 25.08 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -177.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.63 HD13 HG13 ' A' ' 22' ' ' VAL . 12.4 pt -140.18 146.57 24.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.24 175.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -97.41 118.74 34.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.102 0.477 . . . . 0.0 110.386 -177.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.486 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 41.3 p -98.06 154.56 17.64 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.516 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.666 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 72.7 mmtt -67.2 -37.63 83.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.024 -176.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.4 HG23 ' H ' ' A' ' 16' ' ' GLU . 2.7 m -152.37 171.32 18.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.835 -176.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.559 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 39.3 tt0 -61.7 -35.26 77.51 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-O 121.219 0.533 . . . . 0.0 109.677 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -56.32 -43.27 78.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.413 175.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.666 ' HG3' ' HB2' ' A' ' 14' ' ' LYS . 6.5 mm-40 -61.52 -41.21 96.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.33 177.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.589 ' HB2' HD12 ' A' ' 87' ' ' ILE . . . -60.78 -41.6 95.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.698 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.559 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.5 mmtp -55.63 -49.07 73.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.563 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -31.41 72.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.016 0.436 . . . . 0.0 111.022 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.63 HG13 HD13 ' A' ' 11' ' ' ILE . 62.8 t -73.78 -51.28 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.172 178.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.598 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 4.5 pp -65.45 -30.67 71.48 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.595 -174.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.516 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 15.3 t70 -57.18 -53.99 51.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.942 0.401 . . . . 0.0 110.798 -178.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -73.79 -33.69 64.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.638 -175.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.712 HD12 ' HB2' ' A' ' 76' ' ' SER . 3.6 pp -73.17 -21.25 60.73 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.345 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -70.53 -30.2 66.88 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.052 0.453 . . . . 0.0 109.978 172.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.516 ' HD3' ' O ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -69.43 -31.6 70.03 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 171.656 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.28 33.12 29.57 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.773 -1.103 . . . . 0.0 113.049 171.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.56 -64.3 1.21 Allowed Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 118.932 -1.604 . . . . 0.0 112.887 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -140.54 118.66 11.95 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.049 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.568 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 32.0 t80 -84.34 -31.21 24.93 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 175.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.435 ' CB ' ' HA2' ' A' ' 49' ' ' GLY . . . -60.68 -34.44 74.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.071 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.77 88.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.319 0.581 . . . . 0.0 110.084 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.689 ' CD1' ' HB3' ' A' ' 26' ' ' LEU . 6.6 mt -66.35 -42.87 87.44 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.94 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.487 ' CB ' HG23 ' A' ' 11' ' ' ILE . . . -64.06 -54.42 34.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.596 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -70.16 -32.07 69.85 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.215 -169.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -81.18 -60.01 2.44 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 2.5 ttmm -102.16 -26.03 13.5 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 116.101 1.889 . . . . 0.0 116.101 -167.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.416 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 52.8 p -81.08 162.17 23.85 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 121.536 -0.728 . . . . 0.0 112.833 -170.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.7 3.43 29.12 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.194 174.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.511 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 36.1 t70 -71.46 -16.29 62.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.444 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.835 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 2.9 pp -56.18 -16.44 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -157.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.671 ' H ' HD11 ' A' ' 44' ' ' ILE . 4.1 mp -57.57 -41.09 78.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.117 0.484 . . . . 0.0 109.936 170.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.5 m -109.43 -14.35 14.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.294 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.835 ' HB1' ' HA ' ' A' ' 43' ' ' ILE . . . -53.04 -28.69 25.75 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.836 0.454 . . . . 0.0 112.142 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 87.8 mtt180 -53.45 -26.71 21.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.319 178.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . 0.465 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 85.9 m-20 -79.43 -0.38 32.73 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.86 0.362 . . . . 0.0 110.885 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.435 ' HA2' ' CB ' ' A' ' 33' ' ' ALA . . . 90.89 33.25 8.41 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 111.359 -0.697 . . . . 0.0 111.359 -173.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . 0.516 ' O ' ' HA ' ' A' ' 9' ' ' SER . . . 71.33 11.01 70.95 Favored Glycine 0 C--N 1.334 0.434 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -175.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.465 ' HB3' ' HB3' ' A' ' 48' ' ' ASN . 9.4 t70 -76.74 119.28 20.3 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.124 -0.538 . . . . 0.0 111.924 -172.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 77.9 mmm -77.66 -21.4 52.19 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.495 172.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 102.8 -169.49 19.18 Favored Glycine 0 N--CA 1.437 -1.27 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.011 -176.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.483 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 93.8 m95 -88.13 112.75 23.04 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.181 0.515 . . . . 0.0 110.824 178.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.685 HD21 ' HD2' ' A' ' 8' ' ' TYR . 2.9 pp -105.14 154.7 19.83 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.686 177.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.618 ' HG2' ' HE ' ' A' ' 5' ' ' ARG . 22.8 mt-10 -88.39 127.99 35.51 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -64.12 151.35 43.44 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 73.02 8.9 5.41 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.02 0.825 . . . . 0.0 111.544 -175.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.2 p -111.49 -0.17 16.3 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 164.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.456 ' CG2' ' HB2' ' A' ' 64' ' ' LEU . 59.5 mt -78.18 129.91 73.91 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.6 -171.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 60' ' ' ILE . 20.8 Cg_exo -66.77 156.97 63.48 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 123.138 2.559 . . . . 0.0 111.916 175.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.67 -26.86 57.45 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.16 -0.927 . . . . 0.0 112.521 -173.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.431 ' HG3' HG21 ' A' ' 79' ' ' ILE . 0.4 OUTLIER -55.74 -52.37 64.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.369 . . . . 0.0 110.795 177.323 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.456 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 6.0 mp -83.09 -12.47 57.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.942 -178.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -67.33 -49.09 65.51 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 172.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -68.05 -13.36 62.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.346 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.868 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -64.67 -27.83 69.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.18 0.514 . . . . 0.0 110.84 177.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 65.38 27.04 72.03 Favored Glycine 0 C--N 1.334 0.462 0 CA-C-N 115.123 -0.944 . . . . 0.0 113.373 174.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.706 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 12.5 mt -97.15 71.22 2.41 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.8 0.333 . . . . 0.0 111.778 -175.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.442 ' HD3' ' HA ' ' A' ' 70' ' ' LYS . 44.2 mmtm -101.97 -25.74 13.66 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.779 0.323 . . . . 0.0 111.663 175.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -92.96 120.94 33.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.822 ' HD2' ' HA ' ' A' ' 92' ' ' ASP . 37.3 ttpt -67.1 144.69 55.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.263 0.554 . . . . 0.0 111.95 -170.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 99.91 -16.3 58.59 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.382 -177.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.418 ' HB3' HD13 ' A' ' 90' ' ' LEU . 9.3 tt0 -81.58 122.89 28.16 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.156 0.503 . . . . 0.0 110.407 -178.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.701 ' HB3' ' HG2' ' A' ' 89' ' ' ARG . 0.6 OUTLIER -142.27 169.63 17.23 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.775 -178.493 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.712 ' HB2' HD12 ' A' ' 26' ' ' LEU . 30.8 t 78.49 56.12 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 O-C-N 124.277 0.986 . . . . 0.0 110.775 -176.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -102.83 117.06 5.66 Favored Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 109.919 -1.272 . . . . 0.0 109.919 169.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 14.3 t -99.24 113.45 34.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.002 0.429 . . . . 0.0 109.957 -174.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.431 HG21 ' HG3' ' A' ' 63' ' ' GLU . 38.9 mm -110.64 120.27 61.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.258 -179.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -81.68 132.02 35.28 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.064 0.459 . . . . 0.0 111.059 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.0 m -114.93 167.09 11.09 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.49 -0.777 . . . . 0.0 108.917 172.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.5 t -72.46 -26.32 61.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.005 0.431 . . . . 0.0 109.866 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.6 m -97.64 -5.54 9.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.265 -177.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.77 -155.77 27.22 Favored Glycine 0 C--O 1.227 -0.342 0 C-N-CA 120.346 -0.93 . . . . 0.0 112.47 -178.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.487 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 82.1 m-85 -127.28 134.73 50.0 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.0 110.782 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.707 HD11 ' HB ' ' A' ' 10' ' ' ILE . 51.0 tp -110.53 135.47 51.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.438 -177.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.675 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 34.7 mm -107.45 126.77 63.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.961 178.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.868 HG11 ' HB1' ' A' ' 67' ' ' ALA . 11.7 p -108.12 140.61 25.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.056 0.455 . . . . 0.0 110.53 -178.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.701 ' HG2' ' HB3' ' A' ' 75' ' ' LEU . 2.5 tmm_? -142.31 133.21 25.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.654 -174.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.706 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 12.7 mt -89.09 109.7 20.51 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 176.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.537 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 20.2 t70 -80.44 -54.14 5.96 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.358 176.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.822 ' HA ' ' HD2' ' A' ' 72' ' ' LYS . 28.3 t70 -155.35 168.7 26.24 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.545 -179.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.604 HD12 HG22 ' A' ' 6' ' ' THR . 31.4 mm -129.97 131.09 66.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.13 -179.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 . . . . . 0 C--N 1.327 -0.402 0 CA-C-O 120.729 0.3 . . . . 0.0 110.629 178.77 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.453 -0.864 0 CA-C-O 121.016 0.34 . . . . 0.0 112.05 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.66 158.95 35.32 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.663 ' HG3' ' HB2' ' A' ' 94' ' ' GLN . 23.9 ptt180 -121.54 139.28 53.71 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.162 -0.615 . . . . 0.0 112.0 -176.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.549 HG21 HD13 ' A' ' 93' ' ' ILE . 85.6 m -126.1 141.13 52.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.863 -175.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.56 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 56.9 ttt180 -101.42 121.41 41.89 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.736 ' HD2' HD23 ' A' ' 55' ' ' LEU . 25.0 m-85 -115.52 130.66 56.95 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.122 0.487 . . . . 0.0 111.886 -178.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.504 ' HB2' ' HE ' ' A' ' 89' ' ' ARG . 16.5 m -112.31 136.31 51.91 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 173.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.628 ' HB ' HD13 ' A' ' 86' ' ' LEU . 2.8 pp -142.31 146.11 22.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 110.262 -0.273 . . . . 0.0 110.262 -175.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.683 HG12 ' HB ' ' A' ' 87' ' ' ILE . 3.0 pt -140.39 143.03 30.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 176.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -99.71 128.33 45.81 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.724 0.297 . . . . 0.0 110.53 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.586 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 11.5 p -103.69 153.82 20.23 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 -178.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -76.94 -31.99 57.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.976 -177.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.411 HG21 ' N ' ' A' ' 16' ' ' GLU . 7.8 m -151.12 166.26 31.35 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.411 ' N ' HG21 ' A' ' 15' ' ' THR . 25.3 tt0 -56.98 -35.26 68.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.269 0.557 . . . . 0.0 110.262 179.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -59.96 -36.96 78.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.842 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.797 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 8.3 mm-40 -66.09 -35.76 81.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.003 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.44 ' HB3' HD11 ' A' ' 87' ' ' ILE . . . -67.88 -47.33 69.15 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.5 178.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 1.6 mptm? -55.93 -44.16 78.08 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.947 177.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.28 -33.11 74.62 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.208 0.528 . . . . 0.0 110.818 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.82 HG21 ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -76.11 -39.72 36.34 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.221 -178.416 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.781 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -72.5 -27.3 62.18 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.216 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -59.22 -41.25 88.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.684 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.29 -47.87 25.87 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 120.867 0.365 . . . . 0.0 110.139 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.781 ' HG ' ' HA ' ' A' ' 23' ' ' LEU . 3.9 pp -67.94 -14.57 63.07 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.694 -0.403 . . . . 0.0 111.165 -178.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -71.01 -24.74 62.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.16 172.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -86.27 -32.75 20.94 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 168.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 78.84 36.64 28.17 Favored Glycine 0 N--CA 1.44 -1.047 0 CA-C-N 114.141 -1.39 . . . . 0.0 112.235 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.3 -62.31 1.99 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 119.106 -1.521 . . . . 0.0 112.191 -176.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 25.8 t0 -139.32 114.41 9.55 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 121.026 -0.27 . . . . 0.0 110.531 176.188 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.531 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 46.1 t80 -85.57 -37.34 19.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.081 0.467 . . . . 0.0 110.27 174.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.38 -33.07 69.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.863 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.65 -41.83 83.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.385 177.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.82 ' HB3' HG21 ' A' ' 22' ' ' VAL . 7.1 mt -60.14 -44.26 95.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.384 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.502 ' O ' ' HB2' ' A' ' 40' ' ' SER . . . -61.07 -48.0 83.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.651 -1.159 . . . . 0.0 111.809 -179.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.7 mtpp -73.54 -42.53 61.6 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.356 -170.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -79.5 -57.9 3.46 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -169.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.797 ' HD3' ' HB3' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -101.38 -25.28 14.0 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.747 0.784 . . . . 0.0 112.662 -168.279 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.502 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 9.8 m -75.86 146.77 39.58 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.469 -172.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -80.01 2.56 23.25 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 122.033 0.92 . . . . 0.0 109.745 174.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.578 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 37.3 t70 -60.2 -16.29 31.92 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.08 -1.418 . . . . 0.0 112.382 176.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.842 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.8 pp -56.17 -16.12 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -156.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.604 ' H ' HD11 ' A' ' 44' ' ' ILE . 3.6 mp -53.39 -42.03 46.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.164 0.507 . . . . 0.0 109.963 169.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.2 m -110.15 -16.67 13.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.035 178.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.842 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -51.47 -28.21 12.61 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -176.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -53.59 -26.61 22.44 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 35.5 p30 -89.82 10.67 22.72 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.973 0.416 . . . . 0.0 110.974 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.56 24.04 27.03 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.815 -177.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 66.98 40.48 93.4 Favored Glycine 0 CA--C 1.507 -0.409 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.329 177.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.482 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 23.5 t70 -119.12 133.59 55.7 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.314 0.578 . . . . 0.0 111.353 -173.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.521 ' HE1' HD12 ' A' ' 10' ' ' ILE . 14.8 mmt -82.26 -19.88 38.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.081 176.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.69 -162.42 15.63 Favored Glycine 0 N--CA 1.44 -1.055 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.011 177.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.543 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 91.1 m95 -95.1 111.72 23.51 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.414 0.626 . . . . 0.0 110.906 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.88 HD12 HG12 ' A' ' 60' ' ' ILE . 2.0 pp -108.71 156.92 19.04 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.483 177.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.475 ' HB2' ' OG1' ' A' ' 59' ' ' THR . 17.6 mp0 -81.76 144.89 30.77 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -64.92 136.5 56.9 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.04 8.06 6.5 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 124.298 0.999 . . . . 0.0 112.731 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.475 ' OG1' ' HB2' ' A' ' 56' ' ' GLU . 62.2 p -111.39 6.07 20.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.093 0.949 . . . . 0.0 108.676 166.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.88 HG12 HD12 ' A' ' 55' ' ' LEU . 13.5 mt -69.47 141.02 90.32 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.381 -175.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.04 142.45 97.34 Favored 'Trans proline' 0 C--O 1.237 0.432 0 C-N-CA 122.232 1.954 . . . . 0.0 110.898 172.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.416 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 1.7 m-20 -55.04 -29.9 58.42 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.857 -169.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.516 ' HA ' ' ND2' ' A' ' 66' ' ' ASN . 35.0 tt0 -65.56 -36.41 83.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.863 0.363 . . . . 0.0 111.106 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.2 mp -83.66 -25.84 30.37 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.499 -0.48 . . . . 0.0 111.047 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.452 ' CG ' ' HB ' ' A' ' 60' ' ' ILE . 52.2 mtmt -73.86 -27.38 61.05 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 177.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . 0.516 ' ND2' ' HA ' ' A' ' 63' ' ' GLU . 3.2 p30 -84.5 -5.78 59.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.064 0.459 . . . . 0.0 110.054 176.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.975 ' HB2' HG13 ' A' ' 88' ' ' VAL . . . -68.21 -28.45 67.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.697 -178.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.39 23.05 45.26 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.979 -0.629 . . . . 0.0 113.315 176.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.627 ' HB3' ' CD1' ' A' ' 90' ' ' LEU . 11.1 mt -101.98 109.57 21.33 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.473 ' HA ' ' HD2' ' A' ' 70' ' ' LYS . 15.2 tptp -102.66 -60.1 1.6 Allowed 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 119.671 -0.812 . . . . 0.0 111.996 171.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.662 ' O ' HD12 ' A' ' 90' ' ' LEU . 25.5 mt-10 -107.81 152.03 24.94 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.268 0.556 . . . . 0.0 112.374 -169.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.676 ' HB2' HG12 ' A' ' 93' ' ' ILE . 35.6 tttp -66.4 138.31 57.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.125 -0.943 . . . . 0.0 112.207 -167.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.94 -9.62 37.1 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.875 -0.678 . . . . 0.0 111.804 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.404 ' HB3' HD13 ' A' ' 90' ' ' LEU . 9.8 tt0 -91.25 114.89 27.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.029 0.442 . . . . 0.0 109.936 175.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.574 HD12 ' HB2' ' A' ' 26' ' ' LEU . 2.4 pt? -143.12 170.08 16.38 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.963 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.689 ' HB2' HD12 ' A' ' 26' ' ' LEU . 23.7 t 78.15 45.71 0.06 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 124.164 0.915 . . . . 0.0 110.159 -172.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -92.89 104.42 3.18 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 171.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 25.4 t -90.51 113.04 25.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -176.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.624 HD11 ' HA ' ' A' ' 67' ' ' ALA . 41.1 mm -103.21 114.2 42.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.81 -176.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.55 ' HG2' ' HE1' ' A' ' 85' ' ' PHE . 4.5 tmtm? -72.02 113.43 9.04 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.108 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 35.5 t -119.05 161.45 20.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.446 -176.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.6 m -65.94 -26.39 67.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.827 177.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 35.6 m -92.79 -5.77 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.746 -178.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.66 -129.65 3.77 Favored Glycine 0 CA--C 1.508 -0.378 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 -176.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.55 ' HE1' ' HG2' ' A' ' 80' ' ' LYS . 97.0 m-85 -134.05 135.26 43.21 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.058 0.456 . . . . 0.0 110.613 177.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.628 HD13 ' HB ' ' A' ' 10' ' ' ILE . 50.5 tp -106.15 135.33 47.81 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.351 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.683 ' HB ' HG12 ' A' ' 11' ' ' ILE . 27.5 mm -105.7 118.6 53.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 178.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.975 HG13 ' HB2' ' A' ' 67' ' ' ALA . 10.7 p -103.82 136.92 34.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-O 121.319 0.581 . . . . 0.0 109.902 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.531 ' HG3' ' CD2' ' A' ' 32' ' ' PHE . 2.4 tmm_? -137.74 119.13 14.73 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.286 -173.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.662 HD12 ' O ' ' A' ' 71' ' ' GLU . 8.4 mt -77.6 109.0 11.19 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.398 176.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.56 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 32.2 t70 -79.59 -54.18 6.13 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 119.824 -0.751 . . . . 0.0 111.533 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.543 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 5.0 t70 -155.5 170.11 22.71 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.164 -177.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.676 HG12 ' HB2' ' A' ' 72' ' ' LYS . 32.7 mm -135.44 128.74 48.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.384 -178.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.663 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . 47.5 mt-30 . . . . . 0 C--N 1.326 -0.444 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 172.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo . . . . . 0 C--O 1.233 0.274 0 CA-C-O 120.838 0.266 . . . . 0.0 111.723 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -69.41 157.16 37.61 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.507 ' HG2' ' HA ' ' A' ' 56' ' ' GLU . 99.9 mtt180 -130.17 151.11 51.05 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.998 0.428 . . . . 0.0 110.448 -176.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.809 HG21 HG13 ' A' ' 93' ' ' ILE . 30.7 m -136.82 137.17 39.48 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.504 -178.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.551 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 62.9 ttt180 -96.95 111.83 23.86 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.345 -0.389 . . . . 0.0 109.953 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -109.79 138.32 46.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.103 0.477 . . . . 0.0 111.308 -179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.526 ' HB2' ' CG ' ' A' ' 89' ' ' ARG . 6.5 m -112.31 132.71 54.82 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 172.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.585 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.7 pp -137.77 144.29 31.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 110.541 -0.17 . . . . 0.0 110.541 -176.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.633 HD12 HG13 ' A' ' 22' ' ' VAL . 6.1 pt -140.43 146.95 23.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 174.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -97.66 126.57 43.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.898 0.38 . . . . 0.0 110.828 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.691 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 12.9 p -103.03 140.37 37.37 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.475 177.411 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -64.65 -32.2 73.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.783 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.417 HG22 ' H ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -150.9 171.71 16.82 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.54 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.655 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 33.8 tt0 -62.2 -36.25 81.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.246 0.546 . . . . 0.0 109.633 -179.116 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -53.89 -40.31 66.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.667 177.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.691 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 8.6 mm-40 -69.14 -41.2 77.62 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.776 -179.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.545 ' HA ' HG23 ' A' ' 13' ' ' THR . . . -59.18 -44.85 92.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.327 177.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.655 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.3 mmtp -55.89 -48.0 76.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.291 176.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.06 -33.07 73.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.108 0.48 . . . . 0.0 110.972 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.633 HG13 HD12 ' A' ' 11' ' ' ILE . 79.4 t -73.73 -50.37 29.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.25 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.816 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -68.17 -30.53 69.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.138 -176.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.457 ' N ' HD11 ' A' ' 23' ' ' LEU . 12.8 t70 -64.3 -41.23 96.97 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.1 0.476 . . . . 0.0 110.235 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -76.07 -39.07 56.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.186 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.816 ' HG ' ' HA ' ' A' ' 23' ' ' LEU . 4.1 pp -71.87 -13.87 61.79 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.159 177.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.454 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 0.5 OUTLIER -62.91 -33.14 74.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.987 172.675 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -71.92 -29.75 64.63 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 121.605 0.717 . . . . 0.0 109.371 172.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.75 29.7 46.72 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.03 -0.987 . . . . 0.0 112.334 178.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.84 -63.2 1.28 Allowed Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 119.377 -1.392 . . . . 0.0 113.326 -175.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 9.4 t0 -139.28 115.72 10.55 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 117.241 0.521 . . . . 0.0 111.86 178.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.487 ' HA ' HD11 ' A' ' 35' ' ' LEU . 73.3 t80 -84.89 -41.07 16.32 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.791 0.329 . . . . 0.0 110.816 172.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.43 -33.47 65.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.111 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.79 -44.52 85.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.091 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.487 HD11 ' HA ' ' A' ' 32' ' ' PHE . 12.9 mt -62.54 -37.26 85.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.395 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.532 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -62.52 -48.28 80.23 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.351 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.659 ' HA ' HG21 ' A' ' 43' ' ' ILE . 54.8 mtpt -79.1 -33.86 44.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.124 -173.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -79.81 -55.68 4.81 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -177.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.858 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -97.85 -24.54 15.38 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.664 0.745 . . . . 0.0 112.919 -168.303 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.532 ' HB3' ' O ' ' A' ' 36' ' ' ALA . 43.2 t -89.6 152.29 21.47 Favored 'General case' 0 C--N 1.291 -1.953 0 O-C-N 121.133 -0.979 . . . . 0.0 113.008 -167.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.38 0.93 39.65 Favored 'General case' 0 C--N 1.334 -0.069 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.102 172.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.451 ' HB3' ' HB1' ' A' ' 46' ' ' ALA . 20.2 t70 -65.07 -15.99 62.97 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.501 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.847 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.6 pp -55.39 -16.35 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -157.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.464 ' N ' HD12 ' A' ' 43' ' ' ILE . 77.7 mt -51.76 -43.11 33.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.258 0.551 . . . . 0.0 109.603 167.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.9 m -109.41 -25.56 10.46 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.139 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.847 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -50.96 -29.0 11.05 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -174.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -53.74 -24.5 15.12 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -89.4 10.65 21.76 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.033 0.445 . . . . 0.0 110.898 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.22 22.83 31.15 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.359 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 62.21 29.19 72.26 Favored Glycine 0 C--N 1.331 0.284 0 N-CA-C 111.679 -0.568 . . . . 0.0 111.679 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -90.56 113.58 25.62 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.289 0.566 . . . . 0.0 111.226 -172.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 96.7 mmm -75.51 -19.22 59.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.111 177.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 100.15 -149.11 18.64 Favored Glycine 0 N--CA 1.437 -1.253 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.641 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.636 ' CZ3' ' HG2' ' A' ' 94' ' ' GLN . 86.7 m95 -109.3 111.82 23.61 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.23 0.538 . . . . 0.0 111.212 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.468 ' O ' HD12 ' A' ' 55' ' ' LEU . 1.4 pp -99.0 153.12 19.1 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.679 174.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.507 ' HA ' ' HG2' ' A' ' 5' ' ' ARG . 21.7 mt-10 -90.51 140.28 29.88 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -67.39 149.56 50.12 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.121 -178.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.32 7.42 6.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.065 -175.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.8 p -112.18 3.91 17.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.717 0.77 . . . . 0.0 109.116 167.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.502 ' HB ' ' HD3' ' A' ' 65' ' ' LYS . 22.2 mt -87.13 136.17 34.12 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.049 -169.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.53 139.47 81.9 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.265 1.977 . . . . 0.0 110.718 171.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.61 -23.86 59.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.136 -172.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -54.01 -47.58 71.34 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.161 0.288 . . . . 0.0 110.892 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 mp -83.33 -23.15 32.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.636 0.255 . . . . 0.0 111.381 -178.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.502 ' HD3' ' HB ' ' A' ' 60' ' ' ILE . 32.1 mmmt -69.83 -37.53 76.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.009 0.433 . . . . 0.0 110.22 176.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -80.19 -5.27 55.81 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.219 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.792 ' HB1' HG12 ' A' ' 88' ' ' VAL . . . -57.69 -25.13 59.86 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.856 0.36 . . . . 0.0 111.918 -179.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.86 19.9 66.72 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.313 177.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.665 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 15.3 mt -95.43 94.12 7.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.186 0.517 . . . . 0.0 111.678 -175.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -101.22 -47.84 4.59 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.936 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.437 ' O ' HD11 ' A' ' 90' ' ' LEU . 35.6 mm-40 -84.74 129.75 34.78 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.078 -171.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.607 ' HE2' ' HA ' ' A' ' 92' ' ' ASP . 63.3 tttm -66.31 117.66 8.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.103 0.478 . . . . 0.0 111.073 -174.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 102.67 -1.16 48.99 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.653 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.54 126.63 30.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.788 ' HB3' HD12 ' A' ' 26' ' ' LEU . 62.8 mt -116.54 166.08 12.5 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.819 -174.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.509 ' HB2' HD11 ' A' ' 26' ' ' LEU . 12.5 t 76.33 57.82 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.877 0.846 . . . . 0.0 111.106 168.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.426 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -102.4 103.84 2.51 Favored Glycine 0 N--CA 1.439 -1.14 0 N-CA-C 110.146 -1.182 . . . . 0.0 110.146 169.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 26.3 t -98.97 113.06 32.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.152 0.501 . . . . 0.0 109.77 -175.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.43 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 79.2 mt -102.29 116.97 46.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.86 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -86.76 127.11 34.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.357 0.599 . . . . 0.0 111.471 -177.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.5 m -128.91 155.2 45.66 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.014 174.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.4 m -59.84 -27.15 66.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.949 0.404 . . . . 0.0 111.424 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 10.0 p -87.23 -17.82 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.477 -177.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 158.86 -171.19 35.45 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.964 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -112.06 140.67 46.55 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.754 0.311 . . . . 0.0 110.904 -176.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.446 HD11 ' HB ' ' A' ' 10' ' ' ILE . 34.1 tp -113.24 135.76 53.48 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.412 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.592 ' HB ' HG12 ' A' ' 11' ' ' ILE . 24.2 mm -104.7 130.69 55.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 177.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.792 HG12 ' HB1' ' A' ' 67' ' ' ALA . 13.6 p -125.18 140.76 47.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -177.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.681 ' NH2' ' HA ' ' A' ' 91' ' ' ASP . 0.2 OUTLIER -142.14 158.7 43.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.327 0.584 . . . . 0.0 110.862 177.023 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.935 HD22 HD12 ' A' ' 93' ' ' ILE . 10.8 mt -99.95 108.86 21.18 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.479 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.681 ' HA ' ' NH2' ' A' ' 89' ' ' ARG . 19.0 t70 -81.07 -54.08 5.85 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.322 -0.551 . . . . 0.0 111.826 177.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.607 ' HA ' ' HE2' ' A' ' 72' ' ' LYS . 9.1 t70 -155.98 152.99 28.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.458 -177.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.935 HD12 HD22 ' A' ' 90' ' ' LEU . 4.7 mp -133.1 128.32 55.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.636 ' HG2' ' CZ3' ' A' ' 54' ' ' TRP . 25.4 pt20 . . . . . 0 C--N 1.327 -0.381 0 CA-C-O 121.264 0.555 . . . . 0.0 110.993 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.446 -1.291 0 N-CA-C 110.509 -0.612 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -71.12 148.89 46.98 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.57 ' HG3' ' HB2' ' A' ' 94' ' ' GLN . 25.0 ptt180 -122.35 129.8 52.48 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.355 0.598 . . . . 0.0 109.9 176.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.56 HG21 HG22 ' A' ' 93' ' ' ILE . 20.6 m -120.27 141.39 50.03 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.056 -0.975 . . . . 0.0 109.987 -174.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.619 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 66.0 ttt180 -95.02 111.0 22.85 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 120.071 -0.652 . . . . 0.0 109.249 177.034 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.4 ' HE2' HD13 ' A' ' 60' ' ' ILE . 15.2 m-85 -106.91 135.08 49.07 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.381 0.61 . . . . 0.0 111.239 -178.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.563 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 20.4 m -112.36 134.82 53.69 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.272 -0.876 . . . . 0.0 108.846 169.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.639 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.8 pp -139.59 143.06 31.46 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -177.125 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.716 ' HA ' ' HB2' ' A' ' 42' ' ' ASP . 1.1 pt -138.04 141.76 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -96.8 117.35 30.89 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -179.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.605 HG22 ' HE3' ' A' ' 39' ' ' LYS . 2.5 p -94.36 147.88 22.78 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.384 0.612 . . . . 0.0 110.916 -175.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.621 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 10.8 mmmm -64.77 -33.85 76.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.649 -171.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.425 ' HG1' ' C ' ' A' ' 14' ' ' LYS . 10.4 m -157.36 171.16 20.89 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 29.5 tt0 -57.63 -35.4 70.44 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.248 0.547 . . . . 0.0 110.323 -179.205 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -54.0 -43.11 69.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.497 176.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.621 ' HG3' ' HB2' ' A' ' 14' ' ' LYS . 8.1 mm-40 -64.32 -42.4 96.34 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.39 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.546 ' HB3' HD13 ' A' ' 87' ' ' ILE . . . -62.07 -46.39 89.35 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.975 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.601 ' HD3' HD23 ' A' ' 23' ' ' LEU . 30.0 mmtp -60.43 -39.67 88.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.971 178.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.19 -31.57 72.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.008 0.432 . . . . 0.0 110.871 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 18' ' ' GLU . 81.4 t -72.92 -50.58 31.69 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.865 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.618 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.2 pp -65.72 -27.64 68.47 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.336 -176.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.409 ' N ' HD11 ' A' ' 23' ' ' LEU . 9.7 t70 -64.1 -53.52 48.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.003 0.43 . . . . 0.0 110.302 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.448 ' HG2' HD23 ' A' ' 35' ' ' LEU . 1.5 tp10 -66.37 -41.4 89.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.976 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.909 HD11 ' HB2' ' A' ' 76' ' ' SER . 3.8 pp -73.08 -16.67 61.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.012 -179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.427 ' N ' HD13 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -71.38 -30.68 66.41 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 175.129 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -76.02 -32.6 59.46 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 169.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 80.62 36.37 23.14 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.518 -1.219 . . . . 0.0 113.749 168.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -85.38 -63.73 1.55 Allowed Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 118.871 -1.633 . . . . 0.0 112.404 -178.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -139.95 121.23 14.92 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.824 0.312 . . . . 0.0 110.93 173.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -84.51 -32.06 24.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.095 0.474 . . . . 0.0 110.3 174.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.65 -35.98 71.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.087 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.32 -36.22 78.98 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.353 0.597 . . . . 0.0 110.289 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.448 HD23 ' HG2' ' A' ' 25' ' ' GLU . 6.6 mt -69.56 -32.92 71.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.242 -178.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.543 ' HB3' HG21 ' A' ' 11' ' ' ILE . . . -71.23 -46.2 61.6 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.562 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.7 mtpt -77.76 -28.75 50.68 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -168.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -79.34 -61.8 1.89 Allowed 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -169.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.605 ' HE3' HG22 ' A' ' 13' ' ' THR . 0.0 OUTLIER -104.16 -21.99 13.47 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 -179.903 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.516 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 10.4 m -75.21 143.73 43.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.205 0.526 . . . . 0.0 111.53 -168.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -76.84 5.84 7.13 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.778 -177.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.716 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 18.9 t70 -64.03 -16.26 61.27 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.243 -1.344 . . . . 0.0 111.767 176.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.867 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.6 pp -55.83 -15.51 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 -159.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.417 ' N ' HD12 ' A' ' 43' ' ' ILE . 66.5 mt -58.11 -44.14 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-O 121.096 0.474 . . . . 0.0 109.849 167.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -109.65 -13.84 14.45 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.931 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.867 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -53.3 -29.07 31.46 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 122.765 0.426 . . . . 0.0 111.777 178.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -55.08 -19.4 7.23 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.513 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.9 m-20 -89.96 0.22 57.21 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.84 0.352 . . . . 0.0 110.614 177.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.47 29.31 14.37 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.131 -0.787 . . . . 0.0 111.131 -173.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . 0.531 ' HA2' ' OD2' ' A' ' 42' ' ' ASP . . . 80.36 -2.64 76.38 Favored Glycine 0 N--CA 1.453 -0.222 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -175.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -73.86 122.23 22.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.101 0.477 . . . . 0.0 111.846 -175.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.466 ' SD ' HG12 ' A' ' 10' ' ' ILE . 87.6 mtp -78.1 -34.46 50.13 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.149 172.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 120.15 -172.14 14.8 Favored Glycine 0 N--CA 1.438 -1.19 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.186 -174.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.527 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 94.6 m95 -89.68 120.71 31.19 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 120.824 0.345 . . . . 0.0 111.078 178.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.481 HD21 ' O ' ' A' ' 55' ' ' LEU . 0.6 OUTLIER -115.7 155.37 27.85 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 174.644 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -88.5 139.57 30.34 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 120.967 0.413 . . . . 0.0 109.924 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -56.96 151.32 15.02 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.337 173.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 72.5 7.11 5.58 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 124.319 1.012 . . . . 0.0 110.943 -172.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.2 m -111.53 -0.25 16.23 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 162.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.69 ' HB ' ' HE2' ' A' ' 65' ' ' LYS . 56.6 mt -88.39 115.59 63.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.62 -176.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.26 157.66 58.87 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.166 2.577 . . . . 0.0 111.65 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.613 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . 4.7 m-20 -56.79 -20.96 25.23 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.915 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.47 -52.64 64.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.478 175.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.415 ' O ' ' HB1' ' A' ' 67' ' ' ALA . 6.3 mp -82.93 -14.23 54.54 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.929 0.395 . . . . 0.0 110.708 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.69 ' HE2' ' HB ' ' A' ' 60' ' ' ILE . 72.2 mmtt -73.3 -34.4 65.71 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 172.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 -75.15 -5.8 46.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.736 174.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.961 ' HB3' HG12 ' A' ' 88' ' ' VAL . . . -74.43 -32.25 62.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.202 175.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 73.8 21.55 79.17 Favored Glycine 0 C--N 1.336 0.529 0 CA-C-N 115.393 -0.821 . . . . 0.0 113.016 176.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.671 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 12.4 mt -86.41 94.64 9.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.071 0.463 . . . . 0.0 111.396 -177.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -100.29 -54.73 2.79 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.308 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.525 ' O ' HD11 ' A' ' 90' ' ' LEU . 36.8 mt-10 -106.92 142.88 35.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.12 0.486 . . . . 0.0 111.56 -172.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.56 ' CD ' ' HA ' ' A' ' 92' ' ' ASP . 28.0 ttpp -66.74 137.12 56.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.702 -168.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.1 -6.28 36.82 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.586 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.581 ' HB3' HD12 ' A' ' 90' ' ' LEU . 8.2 tt0 -91.65 116.41 28.85 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.53 0.681 . . . . 0.0 110.034 176.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.672 ' HG ' HD12 ' A' ' 26' ' ' LEU . 2.1 pt? -139.53 169.81 17.07 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.909 ' HB2' HD11 ' A' ' 26' ' ' LEU . 37.1 t 78.87 59.98 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 122.288 1.042 . . . . 0.0 109.877 -167.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -111.7 108.6 2.33 Favored Glycine 0 N--CA 1.439 -1.103 0 CA-C-N 114.192 -1.367 . . . . 0.0 109.79 168.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 37.4 t -92.11 113.6 27.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.0 0.429 . . . . 0.0 110.415 -173.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.53 HD11 ' HB2' ' A' ' 67' ' ' ALA . 71.3 mt -106.87 122.13 60.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.828 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 58.2 tttp -85.54 128.99 34.92 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.216 0.532 . . . . 0.0 110.794 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.2 m -118.66 161.51 19.96 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 174.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 26.2 t -69.58 -28.56 66.07 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.184 0.516 . . . . 0.0 109.707 176.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 10.7 p -84.33 -12.95 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.607 -177.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 157.94 -139.22 6.22 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.749 -0.738 . . . . 0.0 111.77 -177.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -131.16 149.38 52.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 117.048 0.424 . . . . 0.0 111.075 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.598 HD11 ' HB ' ' A' ' 10' ' ' ILE . 40.3 tp -121.41 135.46 55.06 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.15 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.639 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 28.9 mm -109.97 126.37 67.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.878 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.961 HG12 ' HB3' ' A' ' 67' ' ' ALA . 7.1 p -108.3 141.87 22.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 121.102 0.477 . . . . 0.0 110.497 -177.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.563 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 1.5 tmm_? -141.21 122.04 14.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.529 -175.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.671 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 9.8 mt -77.7 108.82 11.18 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.842 176.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.619 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 34.3 t70 -80.8 -54.17 5.84 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 119.32 -0.952 . . . . 0.0 111.54 175.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.56 ' HA ' ' CD ' ' A' ' 72' ' ' LYS . 2.7 t70 -156.47 170.69 21.74 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.71 -177.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.56 HG22 HG21 ' A' ' 6' ' ' THR . 0.4 OUTLIER -137.48 136.84 46.27 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-O 121.086 0.47 . . . . 0.0 110.976 175.827 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.57 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . 19.0 mt-30 . . . . . 0 C--N 1.322 -0.599 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.554 178.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo . . . . . 0 N--CA 1.448 -1.182 0 N-CA-C 110.841 -0.484 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -70.03 155.44 40.59 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -113.95 138.54 50.21 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 120.622 -0.431 . . . . 0.0 109.923 -175.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.685 HG21 HG13 ' A' ' 93' ' ' ILE . 10.8 m -120.75 137.77 54.34 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.335 -178.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.417 ' HB2' ' CE2' ' A' ' 54' ' ' TRP . 67.8 ttt180 -101.85 111.96 24.41 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.712 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.641 ' HD2' HD23 ' A' ' 55' ' ' LEU . 17.7 m-85 -107.03 133.45 51.66 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.673 -177.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.522 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 2.6 m -98.28 132.54 43.68 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 168.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.678 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.24 147.04 21.75 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -177.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.737 ' HB ' ' HG ' ' A' ' 40' ' ' SER . 3.3 pt -138.16 142.47 35.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 C-N-CA 120.423 -0.511 . . . . 0.0 109.71 177.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -97.49 115.52 27.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.094 0.473 . . . . 0.0 110.006 -177.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.405 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 77.3 p -99.01 148.93 23.5 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.398 -177.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -69.23 -34.23 74.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.77 -174.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -152.41 174.76 13.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.998 0.427 . . . . 0.0 111.923 -178.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -65.48 -26.46 67.94 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.56 -45.21 92.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.295 177.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.568 ' OE1' ' HG3' ' A' ' 39' ' ' LYS . 81.3 mm-40 -65.78 -44.86 84.49 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.635 176.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . 0.583 ' HA ' HD11 ' A' ' 87' ' ' ILE . . . -56.41 -48.04 77.76 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.427 -176.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 1.5 mptm? -64.21 -33.54 76.04 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.17 -41.5 70.27 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.085 0.469 . . . . 0.0 110.418 177.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.703 HG11 HD23 ' A' ' 26' ' ' LEU . 93.0 t -71.51 -49.17 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.368 -178.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.584 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.5 pp -63.01 -28.56 70.19 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.031 -176.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.459 ' N ' HD11 ' A' ' 23' ' ' LEU . 9.1 t70 -65.88 -48.81 70.27 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.174 0.511 . . . . 0.0 109.952 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.445 ' HG2' HD22 ' A' ' 35' ' ' LEU . 6.6 tp10 -66.24 -43.98 85.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.679 -178.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.703 HD23 HG11 ' A' ' 22' ' ' VAL . 4.3 pp -73.43 -19.04 61.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.105 -178.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -75.0 -24.88 58.47 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.882 0.372 . . . . 0.0 110.45 176.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -71.92 -24.23 61.6 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 170.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.72 25.84 52.07 Favored Glycine 0 N--CA 1.443 -0.849 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.517 175.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.21 -63.6 1.25 Allowed Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 119.154 -1.498 . . . . 0.0 113.061 -176.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -140.07 114.81 9.47 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.255 0.528 . . . . 0.0 111.604 177.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.553 ' HA ' HD13 ' A' ' 35' ' ' LEU . 60.2 t80 -86.78 -41.34 14.17 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.325 0.583 . . . . 0.0 109.874 170.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.648 ' O ' ' HG2' ' A' ' 37' ' ' LYS . . . -58.61 -35.44 72.46 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.221 -176.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.04 -38.42 88.34 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.49 0.662 . . . . 0.0 110.355 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.599 ' HB3' HG13 ' A' ' 22' ' ' VAL . 11.6 mt -65.32 -36.21 83.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.301 178.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.645 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -67.41 -41.24 85.2 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.612 -1.176 . . . . 0.0 111.126 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.648 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 13.5 mmmm -69.62 -46.37 66.39 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.655 -173.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -59.35 2.75 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 -166.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.568 ' HG3' ' OE1' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -100.27 -21.87 15.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.109 -174.692 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.737 ' HG ' ' HB ' ' A' ' 11' ' ' ILE . 35.4 t -69.08 146.38 52.63 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 120.839 0.352 . . . . 0.0 111.515 -171.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.41 0.1 43.62 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.837 0.827 . . . . 0.0 109.931 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.588 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 38.6 t70 -66.54 -16.07 63.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.329 -1.305 . . . . 0.0 112.428 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.864 ' HA ' ' HB2' ' A' ' 46' ' ' ALA . 2.8 pp -55.16 -16.61 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -150.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 65.8 mt -61.97 -39.84 85.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 118.421 0.555 . . . . 0.0 109.646 169.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m -92.2 -30.88 15.69 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.322 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.864 ' HB2' ' HA ' ' A' ' 43' ' ' ILE . . . -52.63 -29.53 26.63 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.335 -176.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -53.58 -30.98 44.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.044 0.449 . . . . 0.0 110.941 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -90.99 9.9 28.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.225 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.28 24.71 28.28 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.586 -177.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . 0.447 ' HA2' ' OD2' ' A' ' 42' ' ' ASP . . . 83.86 8.44 84.28 Favored Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 -176.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -72.34 108.74 5.62 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.214 0.531 . . . . 0.0 111.39 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.403 ' HE3' ' HB3' ' A' ' 52' ' ' MET . 54.2 mmm -82.48 -24.06 34.39 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.753 176.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 130.07 -160.36 22.9 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.036 -175.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.637 ' CH2' ' HG2' ' A' ' 94' ' ' GLN . 81.0 m95 -107.72 138.52 43.8 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.886 0.374 . . . . 0.0 110.993 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.641 HD23 ' HD2' ' A' ' 8' ' ' TYR . 3.5 pp -126.24 156.18 40.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.208 176.053 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -82.2 130.51 35.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.077 0.465 . . . . 0.0 110.455 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -70.29 147.05 50.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.165 178.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 71.65 7.24 5.91 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 124.34 1.025 . . . . 0.0 111.788 -176.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.1 p -111.7 2.1 17.04 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 166.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.573 ' HB ' ' HE3' ' A' ' 65' ' ' LYS . 45.6 mt -69.72 128.46 91.97 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 114.215 -1.357 . . . . 0.0 111.257 -173.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.98 157.01 61.57 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 122.833 2.356 . . . . 0.0 111.445 174.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.515 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . 7.4 p-10 -56.68 -21.37 27.19 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.601 -172.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.677 ' HG3' HG21 ' A' ' 79' ' ' ILE . 39.4 tt0 -56.29 -56.59 19.22 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.087 0.242 . . . . 0.0 110.614 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.8 mp -83.72 -16.62 44.2 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.504 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.573 ' HE3' ' HB ' ' A' ' 60' ' ' ILE . 31.8 mmtp -60.13 -35.29 74.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.217 0.532 . . . . 0.0 110.435 174.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -78.3 -5.82 53.22 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.772 -178.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.79 -32.24 46.31 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.195 0.521 . . . . 0.0 110.419 177.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 68.98 22.09 75.67 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.326 -0.852 . . . . 0.0 113.339 176.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.708 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 6.6 mt -86.81 88.49 7.69 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.004 0.43 . . . . 0.0 111.707 -174.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.427 ' HA ' ' HD2' ' A' ' 70' ' ' LYS . 23.1 tptp -100.58 -39.98 7.63 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 178.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -95.94 128.35 42.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.955 -174.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.622 ' HB2' HD12 ' A' ' 93' ' ' ILE . 82.6 tttt -66.58 134.73 52.95 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.151 0.501 . . . . 0.0 111.044 -172.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.13 -1.63 35.28 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.538 -177.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -92.16 130.77 37.8 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.166 0.507 . . . . 0.0 110.554 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.481 ' HB3' HD11 ' A' ' 26' ' ' LEU . 2.1 mp -118.82 169.77 9.57 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.691 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.2 t 78.98 60.95 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.797 0.808 . . . . 0.0 112.593 169.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -109.21 102.84 1.7 Allowed Glycine 0 N--CA 1.443 -0.849 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 163.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 19.9 t -100.46 113.88 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.482 0 CA-C-O 121.004 0.43 . . . . 0.0 110.007 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.677 HG21 ' HG3' ' A' ' 63' ' ' GLU . 51.5 mm -109.62 127.01 66.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.7 -177.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -77.6 125.31 29.14 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.379 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.0 m -119.9 163.79 17.02 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.029 178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.2 m -68.91 -26.4 65.07 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.25 0.548 . . . . 0.0 110.262 177.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 14.7 p -84.1 -12.54 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.238 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.7 -133.06 4.14 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.007 -0.616 . . . . 0.0 111.786 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -130.1 139.41 50.94 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.658 0.265 . . . . 0.0 110.511 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.678 HD11 ' HB ' ' A' ' 10' ' ' ILE . 29.9 tp -120.48 135.67 54.99 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -178.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.583 HD11 ' HA ' ' A' ' 19' ' ' ALA . 5.0 mt -119.23 125.88 74.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.553 HG22 HD13 ' A' ' 69' ' ' LEU . 1.8 m -113.16 145.9 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-O 121.486 0.66 . . . . 0.0 111.311 -174.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.548 ' HD3' ' CG ' ' A' ' 32' ' ' PHE . 34.3 ttp180 -134.58 145.86 49.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.196 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.834 HD21 HD11 ' A' ' 93' ' ' ILE . 14.6 mt -87.42 108.29 18.94 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.079 0.466 . . . . 0.0 111.284 179.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.477 ' O ' ' HE3' ' A' ' 72' ' ' LYS . 3.7 t0 -80.92 -53.76 6.17 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.897 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.403 ' C ' HD13 ' A' ' 93' ' ' ILE . 10.8 m-20 -154.51 160.36 41.51 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.113 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.834 HD11 HD21 ' A' ' 90' ' ' LEU . 3.4 mp -136.05 127.69 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 172.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.637 ' HG2' ' CH2' ' A' ' 54' ' ' TRP . 81.6 mm-40 . . . . . 0 C--N 1.331 -0.226 0 CA-C-O 120.768 0.318 . . . . 0.0 110.36 177.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo . . . . . 0 N--CA 1.447 -1.258 0 CA-C-O 120.797 0.249 . . . . 0.0 111.73 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -70.81 158.12 36.9 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 176.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -121.99 135.0 54.81 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 120.033 -0.667 . . . . 0.0 110.389 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.726 HG23 HG13 ' A' ' 93' ' ' ILE . 22.3 m -128.67 133.59 48.26 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.311 -177.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.616 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 34.1 ttt180 -95.44 111.47 23.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.64 ' HD2' HD23 ' A' ' 55' ' ' LEU . 14.7 m-85 -103.96 135.4 45.55 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.283 -178.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.659 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 0.7 OUTLIER -96.33 132.18 42.09 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 168.588 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.852 ' HB ' HD13 ' A' ' 86' ' ' LEU . 2.8 pp -142.7 141.38 27.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.61 HG12 ' HB ' ' A' ' 87' ' ' ILE . 5.6 pt -140.49 149.15 21.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -103.27 113.32 26.72 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.496 -174.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.788 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 16.1 p -94.66 141.83 28.16 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.261 178.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -64.55 -30.78 71.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.782 -174.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.31 173.67 14.21 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.525 ' HG2' ' HE2' ' A' ' 20' ' ' LYS . 32.2 tt0 -64.13 -36.58 84.5 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -53.05 -39.54 63.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.979 177.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.788 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 6.1 mm-40 -67.38 -37.1 82.61 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.776 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.83 -39.52 94.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.088 179.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.525 ' HE2' ' HG2' ' A' ' 16' ' ' GLU . 5.1 mptp? -55.55 -48.41 74.78 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.098 176.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.13 -31.05 72.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.961 0.41 . . . . 0.0 111.126 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.497 HG12 HD11 ' A' ' 11' ' ' ILE . 94.4 t -75.68 -51.91 19.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.074 179.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.465 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -66.64 -27.78 67.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.252 -176.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.449 ' N ' HD12 ' A' ' 23' ' ' LEU . 28.1 t70 -64.26 -46.72 82.49 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.759 0.314 . . . . 0.0 111.209 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.443 ' HB3' HD21 ' A' ' 35' ' ' LEU . 29.9 tt0 -75.35 -40.15 58.5 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.29 -176.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.741 HD12 HD12 ' A' ' 75' ' ' LEU . 2.8 pp -69.96 -13.66 62.34 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.661 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.436 ' N ' HD13 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -69.5 -21.03 63.71 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.95 174.551 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -88.99 -26.19 21.62 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 169.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.74 33.93 26.17 Favored Glycine 0 N--CA 1.449 -0.496 0 CA-C-N 114.609 -1.178 . . . . 0.0 113.397 170.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.67 -63.41 1.48 Allowed Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 119.025 -1.559 . . . . 0.0 112.839 -176.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.527 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 3.0 m-20 -139.48 116.65 11.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.883 0.342 . . . . 0.0 111.613 177.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.514 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 43.3 t80 -81.71 -37.87 26.66 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 169.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.49 -37.72 65.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.834 176.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.72 -39.13 84.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.581 -178.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 31' ' ' ASP . 11.4 mt -66.99 -43.04 83.99 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.196 177.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.459 ' HB2' ' HB3' ' A' ' 46' ' ' ALA . . . -59.28 -53.29 59.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.394 -1.276 . . . . 0.0 111.892 -177.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.448 ' HA ' HG22 ' A' ' 43' ' ' ILE . 40.2 mtpt -75.66 -29.5 59.1 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.906 -169.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -79.92 -56.03 4.55 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.826 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 1.2 tppp? -97.66 -24.74 15.37 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -163.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.61 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 24.7 p -92.17 156.56 17.25 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.024 -1.048 . . . . 0.0 112.387 -165.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.98 6.07 19.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.335 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.46 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 13.1 t70 -75.27 -15.24 60.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.051 -0.977 . . . . 0.0 112.218 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.847 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 2.7 pp -55.8 -15.98 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -152.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.475 ' N ' HD13 ' A' ' 43' ' ' ILE . 58.3 mt -53.93 -37.56 34.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 118.427 0.558 . . . . 0.0 109.748 169.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 p -107.72 -25.09 11.45 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.483 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.847 ' HB1' ' HA ' ' A' ' 43' ' ' ILE . . . -56.65 -29.21 62.01 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 178.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.527 ' HG3' ' O ' ' A' ' 43' ' ' ILE . 99.2 mtt180 -57.87 -15.84 9.88 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.866 0.365 . . . . 0.0 111.524 176.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -89.65 10.73 22.08 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.654 0.74 . . . . 0.0 109.866 176.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.54 10.19 62.17 Favored Glycine 0 N--CA 1.453 -0.187 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.074 -177.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . 0.426 ' HA2' ' HA ' ' A' ' 46' ' ' ALA . . . 96.57 -13.5 65.36 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.109 177.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASP . . . . . 0.515 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 47.6 m-20 -72.95 114.4 11.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.497 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 27.0 ptm -71.93 -21.81 61.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.899 -177.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 132.23 -159.62 23.4 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.86 -179.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.439 ' CH2' ' HG3' ' A' ' 94' ' ' GLN . 86.1 m95 -109.04 117.02 33.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.82 0.343 . . . . 0.0 110.633 -179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.64 HD23 ' HD2' ' A' ' 8' ' ' TYR . 2.0 pp -103.66 151.81 22.53 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.79 174.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -92.39 136.77 32.92 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.103 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -57.04 147.99 22.8 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.144 177.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.73 6.99 6.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.263 -0.881 . . . . 0.0 112.383 -178.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 p -111.81 7.45 20.18 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 163.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.622 ' HB ' ' HE3' ' A' ' 65' ' ' LYS . 36.1 mt -86.24 127.25 62.17 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.633 -174.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -65.91 151.74 83.31 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.445 2.096 . . . . 0.0 111.396 174.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -59.34 -17.88 33.42 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.349 -176.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -64.04 -47.28 80.81 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.778 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.8 mp -83.4 -15.06 51.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.825 0.345 . . . . 0.0 110.659 177.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.622 ' HE3' ' HB ' ' A' ' 60' ' ' ILE . 33.2 mmtp -63.34 -30.51 71.63 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.487 0.66 . . . . 0.0 109.764 173.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -74.0 -11.52 60.36 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.263 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.618 ' HB3' HG12 ' A' ' 88' ' ' VAL . . . -70.49 -31.35 68.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.1 0.476 . . . . 0.0 111.151 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.47 19.3 64.43 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.751 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.701 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 18.6 mt -85.34 90.9 8.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.048 0.451 . . . . 0.0 111.142 -176.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -100.41 -43.49 6.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.66 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -107.64 135.31 49.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.764 0.316 . . . . 0.0 110.905 -174.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . 0.603 ' HZ1' ' HB3' ' A' ' 72' ' ' LYS . 6.7 ttpm? -66.58 138.97 57.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.767 -171.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.39 -5.19 35.42 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -94.19 128.49 40.66 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.231 0.538 . . . . 0.0 110.035 177.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.741 HD12 HD12 ' A' ' 26' ' ' LEU . 1.2 pp -145.14 170.91 15.31 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.902 -175.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.625 ' HB2' ' CD1' ' A' ' 26' ' ' LEU . 25.6 t 79.25 49.71 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.425 1.078 . . . . 0.0 110.809 -174.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.417 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -98.72 110.73 4.07 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 168.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.29 113.36 39.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -176.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.543 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 47.5 mm -97.0 114.84 34.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.478 -175.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.762 ' HG2' ' CE2' ' A' ' 85' ' ' PHE . 2.4 tmtp? -83.62 113.92 21.18 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.166 -174.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.7 m -122.93 167.41 13.61 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.134 176.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.5 t -84.59 -26.32 28.02 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 32.9 m -77.78 -10.45 13.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.241 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 149.24 -159.38 28.03 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.416 -0.674 . . . . 0.0 111.416 -179.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' PHE . . . . . 0.762 ' CE2' ' HG2' ' A' ' 80' ' ' LYS . 91.1 m-85 -125.66 132.5 52.42 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.848 0.356 . . . . 0.0 110.513 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.852 HD13 ' HB ' ' A' ' 10' ' ' ILE . 41.6 tp -107.19 135.37 48.84 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.147 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.667 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 22.4 mm -108.1 124.14 64.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.618 HG12 ' HB3' ' A' ' 67' ' ' ALA . 12.1 p -113.51 139.5 38.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.355 0.597 . . . . 0.0 111.232 -175.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . 0.659 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 7.5 ttp180 -136.49 148.0 47.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.815 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.701 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.9 mt -94.72 109.42 21.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.619 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.616 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 37.1 t70 -80.46 -55.05 5.15 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 119.942 -0.703 . . . . 0.0 111.58 175.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . 0.581 ' HA ' ' HD3' ' A' ' 72' ' ' LYS . 35.9 t70 -157.13 160.21 38.59 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.62 0.248 . . . . 0.0 111.232 177.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.726 HG13 HG23 ' A' ' 6' ' ' THR . 3.8 mp -124.73 127.1 72.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 172.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . 0.439 ' HG3' ' CH2' ' A' ' 54' ' ' TRP . 20.9 mt-30 . . . . . 0 C--N 1.327 -0.408 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -176.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.6 m . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 121.07 0.462 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.535 ' HB2' ' HD2' ' A' ' 3' ' ' PRO . 17.5 pt20 -145.73 168.36 12.02 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -178.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.535 ' HD2' ' HB2' ' A' ' 2' ' ' GLN . 73.2 Cg_endo -79.65 133.59 10.51 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.694 2.263 . . . . 0.0 113.429 -175.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.448 ' HG3' ' HB2' ' A' ' 57' ' ' ASP . 13.1 pt20 -70.74 160.15 33.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.323 172.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.473 ' HB2' ' CG ' ' A' ' 94' ' ' GLN . 99.3 mtt180 -122.59 151.18 41.68 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.995 0.426 . . . . 0.0 111.024 -177.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.642 HG23 HD11 ' A' ' 93' ' ' ILE . 32.2 m -135.19 136.04 41.49 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.516 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.616 ' HD3' ' OD1' ' A' ' 91' ' ' ASP . 63.3 ttt180 -100.84 111.39 23.6 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.779 ' HD2' HD21 ' A' ' 55' ' ' LEU . 19.5 m-85 -106.84 141.06 38.67 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.742 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.478 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 14.7 m -112.84 131.95 55.49 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 169.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.612 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.7 pp -142.59 141.58 27.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 N-CA-C 110.369 -0.234 . . . . 0.0 110.369 -173.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.645 HD11 HG13 ' A' ' 22' ' ' VAL . 10.5 pt -140.42 144.87 26.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -103.37 128.97 50.33 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.924 0.392 . . . . 0.0 110.743 -176.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.699 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 10.9 p -109.0 156.21 20.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.186 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.485 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 71.9 mmtt -65.62 -49.1 69.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.379 -179.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.99 175.61 9.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.557 -177.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.666 ' HG2' ' HD3' ' A' ' 20' ' ' LYS . 26.7 tt0 -63.4 -31.32 72.44 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 176.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -56.62 -45.66 81.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.363 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.699 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 8.4 mm-40 -65.5 -43.01 91.49 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.97 179.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.82 -47.43 85.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.915 178.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.666 ' HD3' ' HG2' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -56.63 -40.85 76.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 175.639 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.92 -37.55 87.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.125 0.488 . . . . 0.0 110.689 177.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.645 HG13 HD11 ' A' ' 11' ' ' ILE . 73.5 t -71.59 -48.23 53.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.371 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.735 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -70.74 -27.85 64.27 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.324 -176.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -61.79 -43.61 98.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.079 0.466 . . . . 0.0 110.16 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.422 ' HG2' HD21 ' A' ' 35' ' ' LEU . 7.5 tp10 -69.66 -46.2 66.68 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.642 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.823 HD13 HD11 ' A' ' 75' ' ' LEU . 3.5 pp -73.0 -13.91 61.32 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.457 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.412 ' N ' HD11 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -66.65 -28.2 68.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.188 0.518 . . . . 0.0 110.125 175.517 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -74.92 -32.19 61.73 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 170.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.14 36.11 13.64 Favored Glycine 0 N--CA 1.444 -0.776 0 CA-C-N 114.555 -1.202 . . . . 0.0 113.24 171.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.79 -64.16 1.26 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 118.877 -1.63 . . . . 0.0 112.741 -178.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -140.31 122.6 15.91 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.904 174.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.609 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 59.3 t80 -84.5 -38.13 20.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.008 0.432 . . . . 0.0 110.232 171.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.58 -38.41 66.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.838 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.492 ' O ' ' HG3' ' A' ' 38' ' ' GLU . . . -64.75 -42.85 94.84 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.504 0.669 . . . . 0.0 110.418 -178.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.461 HD13 ' HA ' ' A' ' 32' ' ' PHE . 9.8 mt -64.07 -36.44 84.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.448 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.568 ' HA ' HG22 ' A' ' 11' ' ' ILE . . . -63.29 -43.85 96.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.309 -1.314 . . . . 0.0 112.174 -176.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.5 -30.17 52.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.945 -173.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 43.6 mt-10 -79.39 -57.81 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -170.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.621 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -99.32 -26.44 14.16 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.655 0.74 . . . . 0.0 112.276 -171.266 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.57 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 37.1 t -67.65 137.56 55.68 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -170.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.25 1.03 38.61 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.662 171.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.555 ' HB3' ' HG ' ' A' ' 40' ' ' SER . 24.9 t70 -69.85 -14.87 62.96 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.952 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.917 ' HA ' ' HB2' ' A' ' 46' ' ' ALA . 2.3 pp -54.6 -14.72 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -155.503 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.819 HD13 ' H ' ' A' ' 44' ' ' ILE . 3.6 mp -51.18 -37.9 18.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 167.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.8 m -109.92 -32.93 6.87 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.816 174.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.917 ' HB2' ' HA ' ' A' ' 43' ' ' ILE . . . -54.58 -29.26 50.95 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.474 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.555 ' HG3' ' O ' ' A' ' 43' ' ' ILE . 80.4 mtp180 -59.34 -15.1 14.24 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 117.718 0.236 . . . . 0.0 111.44 178.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -83.69 9.64 11.2 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.974 0.416 . . . . 0.0 110.536 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.1 26.17 22.35 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 111.605 -0.598 . . . . 0.0 111.605 -176.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 83.64 -8.06 66.97 Favored Glycine 0 C--N 1.329 0.181 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -73.26 116.22 13.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.889 0.376 . . . . 0.0 111.184 -177.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.576 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 26.0 ptm -82.24 -19.38 39.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.697 176.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 118.24 177.0 17.0 Favored Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.957 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.565 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 72.2 m95 -84.37 114.68 22.05 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.682 0.277 . . . . 0.0 110.781 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.779 HD21 ' HD2' ' A' ' 8' ' ' TYR . 3.1 pp -98.01 155.72 16.97 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.594 175.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.418 ' HG2' ' HG2' ' A' ' 5' ' ' ARG . 35.5 mt-10 -96.63 145.33 25.85 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.448 ' HB2' ' HG3' ' A' ' 4' ' ' GLN . 13.8 t70 -65.13 141.2 58.78 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -176.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 72.14 9.22 5.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.335 -177.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 15.8 p -110.45 -0.1 17.6 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 167.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.65 HG12 HD12 ' A' ' 55' ' ' LEU . 25.0 mt -71.55 129.87 88.09 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.945 -176.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . 0.424 ' HG2' HD11 ' A' ' 64' ' ' LEU . 30.1 Cg_endo -65.03 148.89 89.82 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.487 2.125 . . . . 0.0 111.169 173.042 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.693 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 0.8 OUTLIER -56.43 -25.24 49.75 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.462 -175.121 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.21 -49.74 75.05 Favored 'General case' 0 C--N 1.319 -0.743 0 O-C-N 123.41 0.444 . . . . 0.0 110.51 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.424 HD11 ' HG2' ' A' ' 61' ' ' PRO . 6.0 mp -83.42 -15.29 50.27 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.693 ' HD2' ' HA ' ' A' ' 62' ' ' ASP . 97.3 mttt -61.48 -31.97 71.97 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.449 0.642 . . . . 0.0 109.879 174.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -83.53 -5.37 59.15 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.6 -178.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.799 ' HB2' HG13 ' A' ' 88' ' ' VAL . . . -69.08 -32.01 71.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.007 0.432 . . . . 0.0 111.598 -178.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 70.19 17.7 74.23 Favored Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.477 174.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.703 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 15.3 mt -91.68 84.49 5.46 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -176.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.469 ' HD3' ' HA ' ' A' ' 70' ' ' LYS . 40.4 mmtm -102.73 -22.77 13.88 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 174.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -94.07 120.24 34.05 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.475 0.178 . . . . 0.0 111.157 -178.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.6 tttp -66.42 130.15 42.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.039 0.447 . . . . 0.0 111.452 -171.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.27 -12.49 40.19 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 111.224 -0.751 . . . . 0.0 111.224 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -78.23 122.29 25.5 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.106 0.479 . . . . 0.0 110.227 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.823 HD11 HD13 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -133.01 169.59 16.61 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.525 -179.673 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.695 ' HB2' HD12 ' A' ' 26' ' ' LEU . 23.1 t 77.99 53.24 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 124.178 0.924 . . . . 0.0 110.297 -174.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -101.11 108.77 3.5 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 110.227 -1.149 . . . . 0.0 110.227 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.2 t -99.17 113.72 34.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.144 0.497 . . . . 0.0 109.972 -176.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.484 HD13 HD23 ' A' ' 86' ' ' LEU . 69.2 mt -98.93 115.29 39.09 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.071 -178.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.561 ' HG2' ' HE2' ' A' ' 85' ' ' PHE . 1.5 tmtp? -81.19 113.66 19.49 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.905 -175.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.0 t -125.78 160.84 28.76 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 12.2 t -74.4 -26.28 59.99 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.156 0.503 . . . . 0.0 109.893 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 25.8 m -79.65 -10.12 12.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.988 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.16 -163.99 27.32 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 111.099 -0.8 . . . . 0.0 111.099 -178.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.561 ' HE2' ' HG2' ' A' ' 80' ' ' LYS . 96.7 m-85 -116.39 129.53 56.29 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.061 0.458 . . . . 0.0 110.892 -176.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.607 HD11 ' HB ' ' A' ' 10' ' ' ILE . 48.4 tp -103.93 135.06 46.16 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.875 -178.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.612 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 22.4 mm -107.64 121.4 60.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.799 HG13 ' HB2' ' A' ' 67' ' ' ALA . 14.8 p -110.5 137.48 42.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 CA-C-O 121.206 0.527 . . . . 0.0 111.024 -176.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.747 ' HG3' ' HB3' ' A' ' 75' ' ' LEU . 7.0 ttp180 -132.14 144.61 50.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.975 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.703 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 10.6 mt -93.22 110.47 21.98 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.359 177.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.616 ' OD1' ' HD3' ' A' ' 7' ' ' ARG . 17.5 t70 -79.06 -54.33 6.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.812 177.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.565 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 6.5 t70 -156.17 165.91 35.0 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.713 0.292 . . . . 0.0 111.529 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.642 HD11 HG23 ' A' ' 6' ' ' THR . 32.9 mm -130.81 128.98 63.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.778 -0.647 . . . . 0.0 109.409 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.473 ' CG ' ' HB2' ' A' ' 5' ' ' ARG . 10.5 pt20 -130.28 131.82 45.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.078 0.466 . . . . 0.0 110.375 176.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -88.72 54.3 2.98 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.238 177.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 72.01 -66.55 0.3 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.366 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . 0.724 ' HA ' ' HB2' ' A' ' 102' ' ' HIS . 31.3 t60 -63.2 -27.12 69.14 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -173.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 6.1 t-80 -68.72 95.3 0.65 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -169.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -179.76 -64.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 174.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 30.1 t60 -149.02 -59.65 0.22 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.073 -0.967 . . . . 0.0 108.551 174.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 31.4 t60 -162.99 114.23 1.48 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.354 172.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.724 ' HB2' ' HA ' ' A' ' 97' ' ' HIS . 73.5 m-70 . . . . . 0 C--O 1.248 0.991 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 168.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 8.6 t . . . . . 0 N--CA 1.479 0.991 0 CA-C-O 120.889 0.376 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -119.03 135.61 23.91 Favored Pre-proline 0 N--CA 1.45 -0.465 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 177.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -85.46 145.63 9.42 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.728 2.285 . . . . 0.0 112.108 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.629 ' CB ' ' HA ' ' A' ' 95' ' ' ALA . 13.8 pt20 -70.35 158.83 35.24 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 175.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.492 ' HG2' ' HA ' ' A' ' 56' ' ' GLU . 99.4 mtt180 -128.28 148.28 50.64 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.305 0.574 . . . . 0.0 111.596 -170.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.606 HG23 HD13 ' A' ' 93' ' ' ILE . 69.8 m -123.16 136.13 54.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.518 -177.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.417 ' HB2' ' CE2' ' A' ' 54' ' ' TRP . 68.5 ttt180 -99.93 111.69 23.99 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.746 ' HD2' HD22 ' A' ' 55' ' ' LEU . 12.4 m-85 -104.61 138.33 41.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.366 0.603 . . . . 0.0 111.549 -178.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.71 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 19.4 m -111.56 133.41 53.85 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 170.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.661 ' HB ' HD13 ' A' ' 86' ' ' LEU . 2.8 pp -142.33 145.68 23.35 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.04 -174.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.664 HG12 ' HB ' ' A' ' 87' ' ' ILE . 3.3 pt -139.75 148.18 23.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -99.65 112.63 24.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.914 0.387 . . . . 0.0 110.667 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 21.7 p -96.12 144.84 26.0 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.186 176.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -84.88 -21.36 29.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.997 -169.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.489 ' O ' ' HB2' ' A' ' 18' ' ' GLU . 4.1 m -147.65 164.57 33.11 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.569 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 26.9 tt0 -69.71 -27.28 64.86 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.17 -39.47 82.61 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.477 172.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.605 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 5.8 mm-40 -64.23 -41.09 97.16 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.935 -1.029 . . . . 0.0 110.165 175.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.57 ' O ' ' HG ' ' A' ' 23' ' ' LEU . . . -63.18 -47.29 83.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.669 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.569 ' HG2' ' O ' ' A' ' 16' ' ' GLU . 74.4 mmtt -55.01 -44.11 74.25 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.156 0.503 . . . . 0.0 110.789 178.132 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.99 -37.07 72.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.151 -179.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.6 HG23 ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -76.2 -38.38 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.745 -175.416 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 19' ' ' ALA . 4.2 pp -72.61 -28.42 62.77 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 121.104 -0.239 . . . . 0.0 111.279 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.518 ' N ' HD13 ' A' ' 23' ' ' LEU . 30.3 t70 -58.01 -41.12 82.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.674 0.274 . . . . 0.0 111.553 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.647 ' HB3' HD22 ' A' ' 35' ' ' LEU . 0.7 OUTLIER -71.37 -44.04 65.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.104 0.478 . . . . 0.0 109.855 -179.367 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.586 ' HB3' ' CD1' ' A' ' 35' ' ' LEU . 3.8 pp -73.16 -16.94 61.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.674 -178.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.89 -25.01 60.92 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.235 0.54 . . . . 0.0 109.667 172.415 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -84.96 -24.55 28.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.918 0.866 . . . . 0.0 108.784 170.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.03 39.91 36.45 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 114.104 -1.407 . . . . 0.0 112.486 175.293 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.47 -64.46 1.44 Allowed Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 118.526 -1.797 . . . . 0.0 112.512 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.477 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 45.3 t0 -141.8 114.98 8.79 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 117.142 0.471 . . . . 0.0 111.127 170.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.621 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 32.8 t80 -77.47 -31.98 54.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.107 0.48 . . . . 0.0 109.747 173.687 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.489 ' HB2' ' HA2' ' A' ' 49' ' ' GLY . . . -64.62 -31.64 72.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.712 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.65 -40.85 84.52 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.357 0.599 . . . . 0.0 109.944 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.647 HD22 ' HB3' ' A' ' 25' ' ' GLU . 14.0 mt -62.25 -44.89 95.51 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.458 178.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.603 ' HB1' ' HB1' ' A' ' 46' ' ' ALA . . . -56.99 -47.48 80.69 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.592 -1.185 . . . . 0.0 111.529 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.507 ' HG2' ' HA ' ' A' ' 47' ' ' ARG . 39.4 mtpt -79.89 -32.99 40.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.153 -172.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -80.36 -60.7 2.22 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -169.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.605 ' HD3' ' HB3' ' A' ' 18' ' ' GLU . 1.1 ttmm -103.11 -25.05 13.54 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.984 0.897 . . . . 0.0 112.813 -170.612 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.534 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 7.5 m -75.31 143.34 42.98 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.519 -169.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -79.19 1.61 23.96 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.611 0.719 . . . . 0.0 110.24 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.561 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 27.8 t70 -65.82 -16.65 64.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.395 176.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.861 ' HA ' ' HB2' ' A' ' 46' ' ' ALA . 3.5 pt -56.21 -17.88 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 114.579 1.325 . . . . 0.0 114.579 -157.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 71.0 mt -51.74 -39.8 25.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.268 0.556 . . . . 0.0 110.014 167.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 35.4 t -112.41 -28.96 7.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.345 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.861 ' HB2' ' HA ' ' A' ' 43' ' ' ILE . . . -51.71 -29.36 18.09 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -175.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.507 ' HA ' ' HG2' ' A' ' 37' ' ' LYS . 89.8 mtt180 -63.71 -8.84 11.44 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.8 p30 -90.38 10.32 25.49 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.958 0.409 . . . . 0.0 110.991 170.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.489 ' HA2' ' HB2' ' A' ' 33' ' ' ALA . . . 92.26 26.51 18.24 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 116.141 -0.482 . . . . 0.0 112.976 -176.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.42 20.06 79.79 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 121.62 -0.324 . . . . 0.0 113.364 173.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -97.0 122.94 40.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.014 0.435 . . . . 0.0 111.033 -176.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.538 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 27.0 ptm -82.68 -19.67 37.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.834 176.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 113.69 -171.22 13.69 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.0 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.537 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 84.4 m95 -90.68 125.47 35.67 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.004 0.43 . . . . 0.0 111.143 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.746 HD22 ' HD2' ' A' ' 8' ' ' TYR . 2.7 pp -115.33 156.51 25.36 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 173.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.525 ' O ' ' HB ' ' A' ' 59' ' ' THR . 25.3 mt-10 -81.67 132.26 35.29 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.964 0.412 . . . . 0.0 110.092 -177.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.573 ' HB3' ' HG3' ' A' ' 4' ' ' GLN . 31.9 t70 -73.22 145.32 46.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.277 -175.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 62.9 7.56 2.69 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.422 -172.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.525 ' HB ' ' O ' ' A' ' 56' ' ' GLU . 13.6 m -112.11 3.01 17.03 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.337 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.694 HG12 HD13 ' A' ' 55' ' ' LEU . 21.8 mt -73.59 133.59 79.88 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 113.835 -1.53 . . . . 0.0 110.865 -173.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.75 155.61 53.11 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.801 2.334 . . . . 0.0 111.839 174.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.667 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 8.9 m-20 -55.54 -27.51 49.31 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.048 -0.978 . . . . 0.0 112.708 -171.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.97 -55.49 32.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.936 178.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.497 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 5.2 mp -83.45 -16.59 45.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.532 -177.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.667 ' HD2' ' HA ' ' A' ' 62' ' ' ASP . 67.6 mttm -56.86 -44.12 81.85 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.602 0.715 . . . . 0.0 109.602 172.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -75.67 -5.34 45.09 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.017 -176.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.833 ' HB3' HG11 ' A' ' 88' ' ' VAL . . . -71.33 -31.09 66.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.037 0.446 . . . . 0.0 111.049 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 77.48 19.08 76.92 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.935 175.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.693 HD13 HG22 ' A' ' 88' ' ' VAL . 11.8 mt -96.11 87.26 4.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.839 0.352 . . . . 0.0 111.309 -177.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -100.69 -41.44 6.91 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -177.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.498 ' O ' HD13 ' A' ' 90' ' ' LEU . 31.5 tt0 -100.32 135.33 41.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.853 0.358 . . . . 0.0 111.351 -174.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.472 ' HE3' ' O ' ' A' ' 91' ' ' ASP . 1.6 tmtp? -66.48 135.39 54.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.522 -170.338 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.58 -11.96 39.08 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.495 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.505 ' HB3' HD11 ' A' ' 90' ' ' LEU . 10.1 tt0 -83.9 127.8 34.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.159 0.504 . . . . 0.0 110.705 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.551 ' HB3' ' HG2' ' A' ' 89' ' ' ARG . 1.4 pp -138.27 170.3 16.27 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.345 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.9 t 78.64 60.37 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 124.106 0.879 . . . . 0.0 111.093 -178.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -110.88 120.31 5.49 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 170.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 25.8 t -107.91 113.51 43.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.216 0.531 . . . . 0.0 110.346 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.472 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 43.9 mm -103.84 118.12 50.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.249 -178.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.445 ' HG3' ' CE2' ' A' ' 85' ' ' PHE . 86.4 tttt -82.87 130.32 35.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.402 0.62 . . . . 0.0 111.164 -178.081 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.3 m -126.96 166.92 16.62 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.041 173.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.3 m -79.04 -26.02 43.16 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.496 0.665 . . . . 0.0 109.337 177.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 33.6 m -85.47 -5.84 10.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.531 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.25 -157.24 27.12 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.884 -0.675 . . . . 0.0 111.851 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.526 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 83.1 m-85 -124.85 136.55 53.91 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 117.035 0.417 . . . . 0.0 110.333 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.661 HD13 ' HB ' ' A' ' 10' ' ' ILE . 57.1 tp -107.78 135.49 49.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.775 0.321 . . . . 0.0 110.382 -178.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.664 ' HB ' HG12 ' A' ' 11' ' ' ILE . 24.9 mm -108.95 127.55 65.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.833 HG11 ' HB3' ' A' ' 67' ' ' ALA . 11.1 p -112.78 141.01 29.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.268 0.556 . . . . 0.0 110.542 -176.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.71 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 1.5 tmm_? -142.16 130.92 22.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.879 -174.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.668 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.8 mt -87.4 109.68 19.74 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 120.702 0.287 . . . . 0.0 111.31 178.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.472 ' O ' ' HE3' ' A' ' 72' ' ' LYS . 11.9 t70 -79.42 -53.92 6.43 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.662 177.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.537 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 28.7 t0 -156.0 164.52 38.35 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.932 -0.307 . . . . 0.0 111.781 -178.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.606 HD13 HG23 ' A' ' 6' ' ' THR . 26.6 mm -134.65 123.84 42.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.125 176.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.655 ' HB2' ' HB2' ' A' ' 98' ' ' HIS . 28.9 pt20 -136.96 134.72 37.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.025 0.441 . . . . 0.0 110.603 178.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.629 ' HA ' ' CB ' ' A' ' 4' ' ' GLN . . . -83.27 62.1 6.49 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.892 0.377 . . . . 0.0 110.637 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.588 ' O ' ' HB3' ' A' ' 102' ' ' HIS . . . 63.76 -84.33 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.817 -177.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -87.4 87.24 7.36 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.209 0.528 . . . . 0.0 109.893 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . 0.655 ' HB2' ' HB2' ' A' ' 94' ' ' GLN . 69.1 t60 -98.05 49.9 1.01 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.962 -175.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.407 ' O ' ' HB2' ' A' ' 100' ' ' HIS . 95.7 m-70 53.93 87.73 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.807 173.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.407 ' HB2' ' O ' ' A' ' 99' ' ' HIS . 43.2 m80 75.05 -27.23 0.19 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.142 0.577 . . . . 0.0 112.394 174.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -71.44 -29.43 64.86 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 172.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.588 ' HB3' ' O ' ' A' ' 96' ' ' ALA . 5.9 t60 . . . . . 0 C--O 1.246 0.912 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.478 0.932 0 CA-C-O 120.809 0.338 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -72.14 141.95 84.36 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.004 176.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -79.55 140.34 14.94 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.647 2.231 . . . . 0.0 112.891 -174.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.677 HE21 ' HA ' ' A' ' 96' ' ' ALA . 1.5 pt20 -75.59 158.65 32.18 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.132 176.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.487 ' HE ' ' HG2' ' A' ' 56' ' ' GLU . 99.7 mtt180 -121.85 145.73 47.79 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.437 0.637 . . . . 0.0 112.11 -171.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 26.1 m -135.09 141.22 46.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.384 -176.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.574 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 57.3 ttt180 -100.4 111.91 24.22 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 177.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.485 ' HE1' ' HB3' ' A' ' 69' ' ' LEU . 23.1 m-85 -106.67 139.67 40.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.154 0.502 . . . . 0.0 111.569 -178.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 9.8 m -117.49 132.38 56.56 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 171.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.722 ' HB ' HD23 ' A' ' 86' ' ' LEU . 2.7 pp -140.69 145.31 25.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -174.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.609 HG22 ' HA ' ' A' ' 36' ' ' ALA . 7.3 pt -140.46 138.56 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -98.13 118.32 34.48 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.986 0.422 . . . . 0.0 110.163 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.708 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 52.7 p -94.34 149.65 21.03 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.246 174.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.545 ' HB2' ' OE2' ' A' ' 18' ' ' GLU . 25.2 mttp -77.75 -25.47 49.21 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.497 -173.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -141.97 168.25 20.2 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.357 176.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.435 ' HB2' ' CZ ' ' A' ' 85' ' ' PHE . 23.9 tt0 -64.68 -32.95 74.84 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -53.71 -41.68 67.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.632 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.708 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 49.9 mt-10 -69.68 -41.31 75.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.384 178.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.548 ' HA ' HD13 ' A' ' 87' ' ' ILE . . . -59.41 -39.1 82.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.405 178.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -55.32 -50.91 68.39 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.812 0.339 . . . . 0.0 110.775 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.21 -30.87 70.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.08 -177.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.792 HG22 ' HE3' ' A' ' 39' ' ' LYS . 21.9 t -75.51 -52.2 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.899 -0.592 . . . . 0.0 109.806 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.462 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -66.48 -28.45 68.59 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.051 -176.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.412 ' N ' HD13 ' A' ' 23' ' ' LEU . 17.8 t70 -64.24 -44.2 92.56 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.025 0.441 . . . . 0.0 110.369 175.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -75.53 -45.45 38.01 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.98 -175.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.782 HD13 HD11 ' A' ' 75' ' ' LEU . 3.1 pp -72.55 -14.93 61.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.746 0.308 . . . . 0.0 110.984 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.477 ' N ' HD11 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -63.01 -27.69 69.59 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 174.009 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.03 -25.62 17.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.767 0.794 . . . . 0.0 109.373 173.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.45 45.63 13.75 Favored Glycine 0 N--CA 1.448 -0.514 0 CA-C-N 114.597 -1.183 . . . . 0.0 113.879 168.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.28 -64.26 1.66 Allowed Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 118.706 -1.711 . . . . 0.0 112.593 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.514 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 45.3 t0 -141.1 115.91 9.71 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 117.109 0.454 . . . . 0.0 111.474 171.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.46 ' HA ' HD13 ' A' ' 35' ' ' LEU . 60.8 t80 -77.19 -33.14 56.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.817 0.342 . . . . 0.0 110.374 174.466 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.3 -30.34 71.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.815 -177.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.6 -42.21 71.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.425 0.631 . . . . 0.0 109.552 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 31' ' ' ASP . 13.0 mt -61.28 -45.05 96.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.1 -0.954 . . . . 0.0 109.258 176.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.609 ' HA ' HG22 ' A' ' 11' ' ' ILE . . . -56.19 -51.05 69.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.31 -1.314 . . . . 0.0 112.244 -176.59 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.649 ' HG2' ' HA ' ' A' ' 47' ' ' ARG . 54.0 mtpt -78.21 -22.65 48.2 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.782 -170.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -80.09 -59.8 2.58 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.792 ' HE3' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -103.33 -22.88 13.63 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -171.834 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.404 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 0.7 OUTLIER -75.18 147.67 40.23 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.413 -163.704 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.15 4.12 24.49 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.826 0.822 . . . . 0.0 109.651 174.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.773 ' HB3' ' HB3' ' A' ' 46' ' ' ALA . 14.6 t70 -68.92 -15.05 63.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.383 -1.281 . . . . 0.0 112.146 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.898 ' HA ' ' HB2' ' A' ' 46' ' ' ALA . 2.4 pp -54.81 -14.97 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -153.471 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.799 ' H ' HD11 ' A' ' 44' ' ' ILE . 4.1 mp -51.62 -40.48 25.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 166.641 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.7 p -120.04 -6.16 9.99 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.675 177.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.898 ' HB2' ' HA ' ' A' ' 43' ' ' ILE . . . -71.39 -29.88 65.45 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.923 -0.486 . . . . 0.0 111.091 179.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.649 ' HA ' ' HG2' ' A' ' 37' ' ' LYS . 79.7 mtp180 -59.09 -28.58 66.63 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.668 -177.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -90.09 13.24 15.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.131 0.491 . . . . 0.0 110.903 176.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.59 21.87 30.43 Favored Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.959 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.37 11.34 76.02 Favored Glycine 0 C--N 1.327 0.062 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.185 175.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -76.3 115.76 16.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.341 -0.429 . . . . 0.0 110.781 -178.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.514 ' SD ' HG12 ' A' ' 10' ' ' ILE . 88.1 mtp -79.6 -20.94 45.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.319 0.58 . . . . 0.0 109.606 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 107.83 -162.17 13.3 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.046 -177.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -95.55 119.26 33.74 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.904 0.383 . . . . 0.0 110.811 178.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.426 ' N ' HD13 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -108.7 155.85 20.25 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.193 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.487 ' HG2' ' HE ' ' A' ' 5' ' ' ARG . 40.2 mt-10 -93.99 131.07 39.82 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.532 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -61.53 148.94 40.45 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.402 -174.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 63.87 6.77 2.9 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.711 -174.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 5.1 m -112.18 -0.74 15.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 122.24 1.019 . . . . 0.0 108.764 168.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.642 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 24.3 mt -75.2 137.61 72.07 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.524 -175.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . 0.5 ' HG2' HD12 ' A' ' 64' ' ' LEU . 18.8 Cg_endo -61.37 146.12 97.54 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.345 2.03 . . . . 0.0 111.244 174.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.65 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 7.8 p-10 -56.59 -24.0 44.53 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.251 -172.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -57.64 -49.03 77.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.356 0.41 . . . . 0.0 110.802 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.5 HD12 ' HG2' ' A' ' 61' ' ' PRO . 6.4 mp -83.1 -15.34 51.23 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.317 -178.185 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.65 ' HD2' ' HA ' ' A' ' 62' ' ' ASP . 94.2 mttt -64.08 -34.32 77.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.584 0.707 . . . . 0.0 110.089 174.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -71.8 -5.72 36.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.527 -178.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.58 ' HB1' HD13 ' A' ' 69' ' ' LEU . . . -70.85 -39.16 73.12 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.088 0.47 . . . . 0.0 111.227 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 72.13 15.4 76.62 Favored Glycine 0 C--N 1.332 0.345 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.132 -174.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.607 ' C ' HD13 ' A' ' 90' ' ' LEU . 6.7 mp -81.33 78.69 8.09 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -174.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 70.7 mmtt -102.44 -16.62 16.12 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 175.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -109.08 125.52 52.22 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 122.214 -0.304 . . . . 0.0 111.278 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.796 ' HB2' HD13 ' A' ' 93' ' ' ILE . 87.5 tttt -66.11 133.4 50.65 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.22 0.533 . . . . 0.0 112.139 -169.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 101.58 -3.88 53.73 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.253 -177.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.62 ' HB3' HD12 ' A' ' 90' ' ' LEU . 10.2 tt0 -80.44 114.43 19.34 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 121.31 0.576 . . . . 0.0 109.722 175.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.782 HD11 HD13 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -133.64 169.78 16.52 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.911 178.8 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.599 ' HB2' HD12 ' A' ' 26' ' ' LEU . 18.5 t 78.56 46.2 0.05 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 122.007 0.908 . . . . 0.0 110.358 -174.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -96.96 103.74 2.95 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 167.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 17.7 t -103.09 113.13 38.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -174.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 59.9 mt -94.1 109.43 22.03 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.602 -177.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.437 ' HD2' ' HE2' ' A' ' 85' ' ' PHE . 26.0 tttt -75.28 113.69 12.95 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.391 -174.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.56 ' HB2' ' O ' ' A' ' 84' ' ' GLY . 14.9 m -126.75 137.87 53.3 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.403 -1.271 . . . . 0.0 107.936 173.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.8 p -62.47 -26.02 68.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.352 -175.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 19.9 m -79.59 -19.4 12.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.297 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . 0.56 ' O ' ' HB2' ' A' ' 81' ' ' SER . . . 161.08 163.59 14.38 Favored Glycine 0 N--CA 1.444 -0.787 0 N-CA-C 111.006 -0.837 . . . . 0.0 111.006 -175.045 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.437 ' HE2' ' HD2' ' A' ' 80' ' ' LYS . 57.8 m-85 -109.6 127.96 54.88 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 120.77 0.319 . . . . 0.0 110.798 -172.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.722 HD23 ' HB ' ' A' ' 10' ' ' ILE . 1.2 tt -111.16 138.49 47.54 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 121.545 0.688 . . . . 0.0 110.666 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.548 HD13 ' HA ' ' A' ' 19' ' ' ALA . 6.5 mt -117.46 121.37 67.42 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 CA-C-N 114.557 -1.202 . . . . 0.0 110.588 -175.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.472 HG23 HD22 ' A' ' 69' ' ' LEU . 7.1 p -113.06 141.38 28.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.667 -176.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.701 ' HB2' ' HB3' ' A' ' 75' ' ' LEU . 2.8 ptm180 -138.45 158.31 44.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.449 0.642 . . . . 0.0 110.72 174.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.837 HD21 HD12 ' A' ' 93' ' ' ILE . 12.9 mt -96.57 109.6 22.17 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.207 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.574 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 21.7 t70 -79.56 -53.91 6.41 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.052 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.474 ' C ' HD11 ' A' ' 93' ' ' ILE . 43.2 t0 -155.03 160.57 41.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.741 -177.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.837 HD12 HD21 ' A' ' 90' ' ' LEU . 1.7 mp -128.87 136.05 60.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.092 -0.503 . . . . 0.0 109.879 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -127.16 119.8 27.3 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.871 0.367 . . . . 0.0 111.322 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . 63.97 24.19 13.54 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.241 175.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.677 ' HA ' HE21 ' A' ' 4' ' ' GLN . . . -112.21 -75.89 0.6 Allowed 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.933 177.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . 0.414 ' H ' HG23 ' A' ' 93' ' ' ILE . 29.7 t-80 -151.21 116.17 5.25 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 175.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -128.75 -78.03 0.56 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.217 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -146.27 -39.15 0.22 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.917 0.389 . . . . 0.0 110.415 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -72.91 167.17 21.56 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.66 173.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 55.1 t60 -69.38 93.06 0.63 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -171.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 8.8 t-80 . . . . . 0 C--O 1.242 0.665 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 171.03 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 2.5 m . . . . . 0 N--CA 1.477 0.923 0 CA-C-O 121.403 0.62 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -172.97 157.6 3.29 Favored Pre-proline 0 N--CA 1.452 -0.368 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.068 -176.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -89.62 109.39 0.43 Allowed 'Trans proline' 0 N--CA 1.446 -1.305 0 C-N-CA 123.017 2.478 . . . . 0.0 111.482 177.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.572 ' HG3' ' HB3' ' A' ' 57' ' ' ASP . 12.7 pt20 -80.74 158.8 25.39 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.639 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 49.6 mtt180 -128.99 151.21 49.93 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.08 0.467 . . . . 0.0 111.51 -171.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.9 m -128.62 131.12 48.08 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.717 176.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.528 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 58.8 ttt180 -95.61 111.74 23.61 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.68 -0.408 . . . . 0.0 109.9 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.65 ' HD2' HD22 ' A' ' 55' ' ' LEU . 22.4 m-85 -106.43 146.47 30.47 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.481 0.658 . . . . 0.0 111.131 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.43 ' HB2' ' HE ' ' A' ' 89' ' ' ARG . 16.2 m -125.86 132.52 52.17 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 169.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.663 ' HB ' HD13 ' A' ' 86' ' ' LEU . 2.9 pp -136.67 149.14 26.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 -175.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.618 HD12 HG13 ' A' ' 22' ' ' VAL . 5.3 pt -140.32 147.59 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 177.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -103.99 121.32 42.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.386 -176.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.753 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 73.8 p -97.86 153.76 18.1 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.61 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -84.9 -25.57 27.85 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.219 -175.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.0 m -149.9 165.24 33.19 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 176.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.668 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 30.6 tt0 -56.12 -39.34 72.07 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.047 0.451 . . . . 0.0 110.384 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -57.53 -38.6 74.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.918 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.951 ' HB3' ' HD2' ' A' ' 39' ' ' LYS . 10.9 mm-40 -64.89 -36.28 83.85 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.82 -176.347 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.615 ' HA ' HD12 ' A' ' 87' ' ' ILE . . . -70.69 -38.61 73.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.595 178.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.668 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.0 mmtp -58.51 -43.66 89.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.308 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.06 -34.27 77.64 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.817 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.618 HG13 HD12 ' A' ' 11' ' ' ILE . 92.1 t -73.52 -49.25 37.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.331 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.686 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.5 pp -65.72 -28.54 69.13 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.215 -176.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.447 ' N ' HD13 ' A' ' 23' ' ' LEU . 19.2 t70 -63.8 -46.47 85.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.097 0.475 . . . . 0.0 110.412 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -75.07 -38.85 61.18 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.854 -175.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 1.102 HD13 ' HB3' ' A' ' 76' ' ' SER . 2.7 pp -72.71 -17.09 61.66 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.153 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.497 ' N ' HD12 ' A' ' 26' ' ' LEU . 2.0 m-80 -69.35 -21.16 63.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.121 0.486 . . . . 0.0 110.139 175.111 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -77.63 -26.2 50.36 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 172.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.13 31.32 52.96 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-N 114.486 -1.234 . . . . 0.0 112.627 173.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -91.2 -64.11 1.18 Allowed Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 118.758 -1.687 . . . . 0.0 113.301 -177.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.458 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 8.0 t0 -140.1 115.47 9.94 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 122.76 -0.259 . . . . 0.0 111.351 177.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.468 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 93.1 t80 -85.4 -41.31 15.55 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.96 0.41 . . . . 0.0 110.893 172.356 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.74 -33.81 61.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.259 -178.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.32 -44.52 75.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.311 178.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 31' ' ' ASP . 12.4 mt -60.57 -38.36 84.33 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.636 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.531 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -59.53 -50.93 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.502 179.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -69.61 -35.33 75.17 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.921 -173.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.49 -55.48 5.18 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -175.54 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.951 ' HD2' ' HB3' ' A' ' 18' ' ' GLU . 1.0 OUTLIER -96.73 -24.04 16.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.701 0.762 . . . . 0.0 112.869 -166.373 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.614 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 29.0 t -93.44 147.38 23.01 Favored 'General case' 0 C--N 1.291 -1.94 0 O-C-N 121.514 -0.741 . . . . 0.0 112.93 -167.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.53 0.62 41.76 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.11 174.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.689 ' HB3' ' HB3' ' A' ' 46' ' ' ALA . 31.4 t70 -59.87 -14.69 16.44 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.46 -1.246 . . . . 0.0 112.666 178.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.927 ' HA ' ' HB2' ' A' ' 46' ' ' ALA . 2.5 pp -54.73 -14.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -152.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.431 ' N ' HD13 ' A' ' 43' ' ' ILE . 44.3 mm -51.82 -33.04 15.19 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 CA-C-O 121.378 0.608 . . . . 0.0 109.539 165.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.8 m -119.62 -20.39 7.73 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.212 174.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.927 ' HB2' ' HA ' ' A' ' 43' ' ' ILE . . . -64.32 -29.98 71.04 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 121.84 -0.537 . . . . 0.0 111.767 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -57.15 -34.28 68.25 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.603 0.239 . . . . 0.0 111.521 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -88.71 13.87 11.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.233 0.54 . . . . 0.0 110.934 176.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.78 24.66 22.6 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.342 -0.844 . . . . 0.0 113.049 178.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.02 14.2 76.1 Favored Glycine 0 CA--C 1.51 -0.254 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.129 174.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -85.58 115.8 23.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.897 0.379 . . . . 0.0 110.311 -176.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.415 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 26.1 ptm -80.64 -19.62 44.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.118 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 115.02 -166.61 12.18 Favored Glycine 0 N--CA 1.439 -1.128 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.737 -178.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.776 ' CZ3' ' HB2' ' A' ' 94' ' ' GLN . 82.4 m95 -98.85 113.37 25.46 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.914 0.387 . . . . 0.0 111.081 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.713 HD11 HG12 ' A' ' 60' ' ' ILE . 2.6 pp -99.64 153.31 19.17 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.372 173.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -84.92 132.72 34.34 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.572 ' HB3' ' HG3' ' A' ' 4' ' ' GLN . 23.8 t70 -67.56 145.39 54.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.292 -175.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 65.4 7.13 4.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.903 -173.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.404 ' H ' ' C ' ' A' ' 57' ' ' ASP . 4.8 m -112.72 9.32 19.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 122.032 0.92 . . . . 0.0 108.828 166.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.713 HG12 HD11 ' A' ' 55' ' ' LEU . 6.0 mt -81.94 137.79 46.64 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.705 -172.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.27 152.36 72.77 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.742 2.295 . . . . 0.0 111.582 176.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.03 -25.26 66.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.77 -168.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.536 ' HA ' ' ND2' ' A' ' 66' ' ' ASN . 41.1 tt0 -70.01 -25.88 63.8 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.377 0.608 . . . . 0.0 110.257 177.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.582 ' HB2' HG21 ' A' ' 60' ' ' ILE . 4.4 mm? -80.93 -22.85 39.33 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.116 176.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -72.97 -44.75 60.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.541 178.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.536 ' ND2' ' HA ' ' A' ' 63' ' ' GLU . 5.0 p30 -74.46 -6.06 46.14 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.967 0.413 . . . . 0.0 110.435 -177.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.938 ' HB2' HG12 ' A' ' 88' ' ' VAL . . . -62.83 -32.22 73.38 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.402 173.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.22 26.82 54.28 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.889 175.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.662 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 10.3 mt -102.64 86.88 2.85 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.839 0.352 . . . . 0.0 111.714 -176.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -101.25 -41.9 6.53 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.671 176.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -94.18 127.87 40.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.92 0.391 . . . . 0.0 111.825 -175.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.832 ' HE2' ' HA ' ' A' ' 92' ' ' ASP . 51.0 tttm -66.71 133.77 50.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.267 -172.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.04 -8.41 38.79 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.25 -0.74 . . . . 0.0 111.25 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -86.93 128.09 35.06 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.143 0.497 . . . . 0.0 109.996 178.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.684 HD13 ' HB2' ' A' ' 26' ' ' LEU . 2.2 pt? -144.62 169.9 17.1 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.823 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 1.102 ' HB3' HD13 ' A' ' 26' ' ' LEU . 57.4 p 78.1 45.79 0.06 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.476 1.51 . . . . 0.0 111.266 -171.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -91.56 103.98 3.11 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 168.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 16.8 t -97.96 113.6 33.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.172 0.51 . . . . 0.0 109.855 -174.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.579 HD12 ' HA ' ' A' ' 67' ' ' ALA . 49.9 mm -103.99 124.07 58.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.439 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -82.56 126.23 32.04 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.132 0.491 . . . . 0.0 110.51 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.7 t -129.53 158.84 38.13 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 175.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.5 p -66.37 -25.84 66.98 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.958 0.409 . . . . 0.0 110.764 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 34.9 m -83.27 -11.36 11.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.423 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.95 -161.39 27.82 Favored Glycine 0 C--O 1.226 -0.366 0 N-CA-C 111.502 -0.639 . . . . 0.0 111.502 -177.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.584 ' HB2' ' OG1' ' A' ' 13' ' ' THR . 95.3 m-85 -111.14 138.68 47.27 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 117.334 0.567 . . . . 0.0 110.842 -178.225 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.663 HD13 ' HB ' ' A' ' 10' ' ' ILE . 36.2 tp -114.53 135.71 53.82 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.944 -177.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.615 HD12 ' HA ' ' A' ' 19' ' ' ALA . 15.7 mt -113.23 121.21 65.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.306 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.938 HG12 ' HB2' ' A' ' 67' ' ' ALA . 14.8 p -106.28 140.42 24.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.071 -175.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.468 ' HD3' ' CG ' ' A' ' 32' ' ' PHE . 15.3 ttp85 -132.23 141.79 49.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.792 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.662 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.0 mt -94.55 108.83 20.77 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.448 175.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.528 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 22.6 t70 -80.62 -54.98 5.17 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.098 -0.641 . . . . 0.0 111.815 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.832 ' HA ' ' HE2' ' A' ' 72' ' ' LYS . 9.1 t70 -156.63 170.13 23.1 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.165 -174.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.408 HG12 ' HB2' ' A' ' 72' ' ' LYS . 45.5 mm -127.59 120.05 53.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.776 ' HB2' ' CZ3' ' A' ' 54' ' ' TRP . 6.9 tt0 -102.3 133.93 46.41 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -169.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.564 ' HA ' ' HD2' ' A' ' 99' ' ' HIS . . . 73.27 -37.38 0.38 Allowed 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 166.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -52.8 102.17 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.595 0.559 . . . . 0.0 112.168 -174.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 70.79 -6.54 1.23 Allowed 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.82 0.7 . . . . 0.0 110.96 178.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -79.55 -29.19 41.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.145 -176.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.564 ' HD2' ' HA ' ' A' ' 95' ' ' ALA . 61.3 m-70 -98.6 29.1 3.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.771 176.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 47.3 t60 68.94 3.7 4.13 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.216 0.531 . . . . 0.0 110.848 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -132.13 134.3 45.28 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.328 0.585 . . . . 0.0 111.957 -178.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 . . . . . 0 C--O 1.249 1.038 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.735 173.92 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 121.099 0.476 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -116.68 165.03 16.2 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 175.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -79.5 143.23 16.95 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.139 1.892 . . . . 0.0 112.11 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.481 ' HB2' ' HA ' ' A' ' 95' ' ' ALA . 12.9 pt20 -70.31 158.46 35.88 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.618 ' HE ' ' HG2' ' A' ' 56' ' ' GLU . 99.1 mtt180 -122.31 135.39 54.72 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.47 0.652 . . . . 0.0 111.741 -173.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.604 HG22 HD12 ' A' ' 93' ' ' ILE . 32.0 m -120.46 137.42 54.35 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.205 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.537 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 62.8 ttt180 -96.25 110.88 23.1 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 177.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.685 ' HD2' HD21 ' A' ' 55' ' ' LEU . 19.2 m-85 -109.27 137.59 46.92 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.144 0.497 . . . . 0.0 111.328 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.682 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 15.3 m -109.8 132.31 54.27 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.464 -0.789 . . . . 0.0 108.913 169.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.707 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.9 pp -142.73 143.82 25.08 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -177.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.63 HD13 HG13 ' A' ' 22' ' ' VAL . 12.4 pt -140.18 146.57 24.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.24 175.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -97.41 118.74 34.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.102 0.477 . . . . 0.0 110.386 -177.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.486 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 41.3 p -98.06 154.56 17.64 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.516 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.666 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 72.7 mmtt -67.2 -37.63 83.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.024 -176.41 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.4 HG23 ' H ' ' A' ' 16' ' ' GLU . 2.7 m -152.37 171.32 18.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.835 -176.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.559 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 39.3 tt0 -61.7 -35.26 77.51 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-O 121.219 0.533 . . . . 0.0 109.677 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -56.32 -43.27 78.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.413 175.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.666 ' HG3' ' HB2' ' A' ' 14' ' ' LYS . 6.5 mm-40 -61.52 -41.21 96.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.33 177.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.589 ' HB2' HD12 ' A' ' 87' ' ' ILE . . . -60.78 -41.6 95.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.698 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.559 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.5 mmtp -55.63 -49.07 73.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.563 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -31.41 72.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.016 0.436 . . . . 0.0 111.022 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.63 HG13 HD13 ' A' ' 11' ' ' ILE . 62.8 t -73.78 -51.28 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.172 178.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.598 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 4.5 pp -65.45 -30.67 71.48 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.595 -174.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.516 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 15.3 t70 -57.18 -53.99 51.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.942 0.401 . . . . 0.0 110.798 -178.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -73.79 -33.69 64.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.638 -175.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.712 HD12 ' HB2' ' A' ' 76' ' ' SER . 3.6 pp -73.17 -21.25 60.73 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.345 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -70.53 -30.2 66.88 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.052 0.453 . . . . 0.0 109.978 172.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.516 ' HD3' ' O ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -69.43 -31.6 70.03 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 171.656 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.28 33.12 29.57 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.773 -1.103 . . . . 0.0 113.049 171.153 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.56 -64.3 1.21 Allowed Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 118.932 -1.604 . . . . 0.0 112.887 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -140.54 118.66 11.95 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.049 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.568 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 32.0 t80 -84.34 -31.21 24.93 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 175.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.435 ' CB ' ' HA2' ' A' ' 49' ' ' GLY . . . -60.68 -34.44 74.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.071 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.77 88.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.319 0.581 . . . . 0.0 110.084 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.689 ' CD1' ' HB3' ' A' ' 26' ' ' LEU . 6.6 mt -66.35 -42.87 87.44 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.94 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.487 ' CB ' HG23 ' A' ' 11' ' ' ILE . . . -64.06 -54.42 34.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.596 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.0 mtpt -70.16 -32.07 69.85 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.215 -169.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -81.18 -60.01 2.44 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 2.5 ttmm -102.16 -26.03 13.5 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 116.101 1.889 . . . . 0.0 116.101 -167.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.416 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 52.8 p -81.08 162.17 23.85 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 121.536 -0.728 . . . . 0.0 112.833 -170.679 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.7 3.43 29.12 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.194 174.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.511 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 36.1 t70 -71.46 -16.29 62.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.444 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.835 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 2.9 pp -56.18 -16.44 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -157.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.671 ' H ' HD11 ' A' ' 44' ' ' ILE . 4.1 mp -57.57 -41.09 78.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.117 0.484 . . . . 0.0 109.936 170.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.5 m -109.43 -14.35 14.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.294 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.835 ' HB1' ' HA ' ' A' ' 43' ' ' ILE . . . -53.04 -28.69 25.75 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.836 0.454 . . . . 0.0 112.142 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 87.8 mtt180 -53.45 -26.71 21.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.319 178.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . 0.465 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 85.9 m-20 -79.43 -0.38 32.73 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.86 0.362 . . . . 0.0 110.885 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.435 ' HA2' ' CB ' ' A' ' 33' ' ' ALA . . . 90.89 33.25 8.41 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 111.359 -0.697 . . . . 0.0 111.359 -173.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.516 ' O ' ' HA ' ' A' ' 9' ' ' SER . . . 71.33 11.01 70.95 Favored Glycine 0 C--N 1.334 0.434 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -175.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.465 ' HB3' ' HB3' ' A' ' 48' ' ' ASN . 9.4 t70 -76.74 119.28 20.3 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.124 -0.538 . . . . 0.0 111.924 -172.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 77.9 mmm -77.66 -21.4 52.19 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.495 172.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 102.8 -169.49 19.18 Favored Glycine 0 N--CA 1.437 -1.27 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.011 -176.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.483 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 93.8 m95 -88.13 112.75 23.04 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.181 0.515 . . . . 0.0 110.824 178.026 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.685 HD21 ' HD2' ' A' ' 8' ' ' TYR . 2.9 pp -105.14 154.7 19.83 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.686 177.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.618 ' HG2' ' HE ' ' A' ' 5' ' ' ARG . 22.8 mt-10 -88.39 127.99 35.51 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -64.12 151.35 43.44 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 73.02 8.9 5.41 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.02 0.825 . . . . 0.0 111.544 -175.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.2 p -111.49 -0.17 16.3 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 164.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.456 ' CG2' ' HB2' ' A' ' 64' ' ' LEU . 59.5 mt -78.18 129.91 73.91 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.6 -171.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 60' ' ' ILE . 20.8 Cg_exo -66.77 156.97 63.48 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 123.138 2.559 . . . . 0.0 111.916 175.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.67 -26.86 57.45 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.16 -0.927 . . . . 0.0 112.521 -173.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.431 ' HG3' HG21 ' A' ' 79' ' ' ILE . 0.4 OUTLIER -55.74 -52.37 64.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.369 . . . . 0.0 110.795 177.323 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.456 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 6.0 mp -83.09 -12.47 57.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.942 -178.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -67.33 -49.09 65.51 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 172.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -68.05 -13.36 62.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.346 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.868 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -64.67 -27.83 69.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.18 0.514 . . . . 0.0 110.84 177.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 65.38 27.04 72.03 Favored Glycine 0 C--N 1.334 0.462 0 CA-C-N 115.123 -0.944 . . . . 0.0 113.373 174.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.706 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 12.5 mt -97.15 71.22 2.41 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.8 0.333 . . . . 0.0 111.778 -175.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.442 ' HD3' ' HA ' ' A' ' 70' ' ' LYS . 44.2 mmtm -101.97 -25.74 13.66 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.779 0.323 . . . . 0.0 111.663 175.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -92.96 120.94 33.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.822 ' HD2' ' HA ' ' A' ' 92' ' ' ASP . 37.3 ttpt -67.1 144.69 55.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.263 0.554 . . . . 0.0 111.95 -170.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 99.91 -16.3 58.59 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.382 -177.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.418 ' HB3' HD13 ' A' ' 90' ' ' LEU . 9.3 tt0 -81.58 122.89 28.16 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.156 0.503 . . . . 0.0 110.407 -178.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.701 ' HB3' ' HG2' ' A' ' 89' ' ' ARG . 0.6 OUTLIER -142.27 169.63 17.23 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.775 -178.493 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.712 ' HB2' HD12 ' A' ' 26' ' ' LEU . 30.8 t 78.49 56.12 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 O-C-N 124.277 0.986 . . . . 0.0 110.775 -176.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -102.83 117.06 5.66 Favored Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 109.919 -1.272 . . . . 0.0 109.919 169.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 14.3 t -99.24 113.45 34.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.002 0.429 . . . . 0.0 109.957 -174.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.431 HG21 ' HG3' ' A' ' 63' ' ' GLU . 38.9 mm -110.64 120.27 61.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.258 -179.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -81.68 132.02 35.28 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.064 0.459 . . . . 0.0 111.059 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.0 m -114.93 167.09 11.09 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.49 -0.777 . . . . 0.0 108.917 172.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.5 t -72.46 -26.32 61.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.005 0.431 . . . . 0.0 109.866 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.6 m -97.64 -5.54 9.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.265 -177.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.77 -155.77 27.22 Favored Glycine 0 C--O 1.227 -0.342 0 C-N-CA 120.346 -0.93 . . . . 0.0 112.47 -178.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.487 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 82.1 m-85 -127.28 134.73 50.0 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.0 110.782 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.707 HD11 ' HB ' ' A' ' 10' ' ' ILE . 51.0 tp -110.53 135.47 51.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.438 -177.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.675 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 34.7 mm -107.45 126.77 63.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.961 178.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.868 HG11 ' HB1' ' A' ' 67' ' ' ALA . 11.7 p -108.12 140.61 25.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.056 0.455 . . . . 0.0 110.53 -178.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.701 ' HG2' ' HB3' ' A' ' 75' ' ' LEU . 2.5 tmm_? -142.31 133.21 25.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.654 -174.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.706 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 12.7 mt -89.09 109.7 20.51 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 176.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.537 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 20.2 t70 -80.44 -54.14 5.96 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.358 176.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.822 ' HA ' ' HD2' ' A' ' 72' ' ' LYS . 28.3 t70 -155.35 168.7 26.24 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.545 -179.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.604 HD12 HG22 ' A' ' 6' ' ' THR . 31.4 mm -129.97 131.09 66.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.13 -179.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -134.63 134.37 41.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.729 0.3 . . . . 0.0 110.629 178.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.481 ' HA ' ' HB2' ' A' ' 4' ' ' GLN . . . -90.31 34.41 0.87 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.135 0.493 . . . . 0.0 109.848 172.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 71.32 -61.39 0.49 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.78 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . 1.014 ' HA ' ' HA ' ' A' ' 102' ' ' HIS . 38.1 p-80 -148.06 104.63 3.57 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.587 0.708 . . . . 0.0 110.114 175.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . 0.467 ' H ' ' C ' ' A' ' 102' ' ' HIS . 11.7 t-160 -66.78 -53.02 37.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.337 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -116.42 -74.05 0.62 Allowed 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.399 -0.521 . . . . 0.0 111.154 -177.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 13.3 t-160 -118.01 -72.52 0.68 Allowed 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.963 -176.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -77.5 -52.24 9.41 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.01 0.433 . . . . 0.0 110.12 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 1.014 ' HA ' ' HA ' ' A' ' 97' ' ' HIS . 21.9 p-80 . . . . . 0 C--O 1.242 0.677 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 173.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 15.3 t . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.512 ' HB2' ' HB2' ' A' ' 97' ' ' HIS . 26.6 mp0 -114.29 141.79 27.02 Favored Pre-proline 0 C--N 1.326 -0.422 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 178.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 2' ' ' GLN . 1.0 OUTLIER -83.95 142.52 10.02 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 123.478 2.786 . . . . 0.0 112.05 -178.885 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.66 158.95 35.32 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.663 ' HG3' ' HB2' ' A' ' 94' ' ' GLN . 23.9 ptt180 -121.54 139.28 53.71 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.162 -0.615 . . . . 0.0 112.0 -176.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.549 HG21 HD13 ' A' ' 93' ' ' ILE . 85.6 m -126.1 141.13 52.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.863 -175.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.56 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 56.9 ttt180 -101.42 121.41 41.89 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.736 ' HD2' HD23 ' A' ' 55' ' ' LEU . 25.0 m-85 -115.52 130.66 56.95 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.122 0.487 . . . . 0.0 111.886 -178.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.504 ' HB2' ' HE ' ' A' ' 89' ' ' ARG . 16.5 m -112.31 136.31 51.91 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 173.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.628 ' HB ' HD13 ' A' ' 86' ' ' LEU . 2.8 pp -142.31 146.11 22.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 110.262 -0.273 . . . . 0.0 110.262 -175.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.683 HG12 ' HB ' ' A' ' 87' ' ' ILE . 3.0 pt -140.39 143.03 30.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 176.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -99.71 128.33 45.81 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.724 0.297 . . . . 0.0 110.53 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.586 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 11.5 p -103.69 153.82 20.23 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 -178.56 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -76.94 -31.99 57.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.976 -177.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.411 HG21 ' N ' ' A' ' 16' ' ' GLU . 7.8 m -151.12 166.26 31.35 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.411 ' N ' HG21 ' A' ' 15' ' ' THR . 25.3 tt0 -56.98 -35.26 68.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.269 0.557 . . . . 0.0 110.262 179.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -59.96 -36.96 78.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.842 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.797 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 8.3 mm-40 -66.09 -35.76 81.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.003 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.44 ' HB3' HD11 ' A' ' 87' ' ' ILE . . . -67.88 -47.33 69.15 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.5 178.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 1.6 mptm? -55.93 -44.16 78.08 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.947 177.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.28 -33.11 74.62 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.208 0.528 . . . . 0.0 110.818 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.82 HG21 ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -76.11 -39.72 36.34 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.221 -178.416 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.781 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -72.5 -27.3 62.18 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.216 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -59.22 -41.25 88.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.684 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.29 -47.87 25.87 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 120.867 0.365 . . . . 0.0 110.139 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.781 ' HG ' ' HA ' ' A' ' 23' ' ' LEU . 3.9 pp -67.94 -14.57 63.07 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.694 -0.403 . . . . 0.0 111.165 -178.006 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -71.01 -24.74 62.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.16 172.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -86.27 -32.75 20.94 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 168.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 78.84 36.64 28.17 Favored Glycine 0 N--CA 1.44 -1.047 0 CA-C-N 114.141 -1.39 . . . . 0.0 112.235 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.3 -62.31 1.99 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 119.106 -1.521 . . . . 0.0 112.191 -176.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.429 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 25.8 t0 -139.32 114.41 9.55 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 121.026 -0.27 . . . . 0.0 110.531 176.188 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.531 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 46.1 t80 -85.57 -37.34 19.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.081 0.467 . . . . 0.0 110.27 174.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.38 -33.07 69.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.863 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.65 -41.83 83.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.385 177.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.82 ' HB3' HG21 ' A' ' 22' ' ' VAL . 7.1 mt -60.14 -44.26 95.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.384 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.502 ' O ' ' HB2' ' A' ' 40' ' ' SER . . . -61.07 -48.0 83.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.651 -1.159 . . . . 0.0 111.809 -179.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.7 mtpp -73.54 -42.53 61.6 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.356 -170.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -79.5 -57.9 3.46 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -169.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.797 ' HD3' ' HB3' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -101.38 -25.28 14.0 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.747 0.784 . . . . 0.0 112.662 -168.279 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.502 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 9.8 m -75.86 146.77 39.58 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.469 -172.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -80.01 2.56 23.25 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 122.033 0.92 . . . . 0.0 109.745 174.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.578 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 37.3 t70 -60.2 -16.29 31.92 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.08 -1.418 . . . . 0.0 112.382 176.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.842 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.8 pp -56.17 -16.12 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -156.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.604 ' H ' HD11 ' A' ' 44' ' ' ILE . 3.6 mp -53.39 -42.03 46.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.164 0.507 . . . . 0.0 109.963 169.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.2 m -110.15 -16.67 13.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.035 178.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.842 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -51.47 -28.21 12.61 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -176.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -53.59 -26.61 22.44 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 35.5 p30 -89.82 10.67 22.72 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.973 0.416 . . . . 0.0 110.974 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.56 24.04 27.03 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.815 -177.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 66.98 40.48 93.4 Favored Glycine 0 CA--C 1.507 -0.409 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.329 177.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.482 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 23.5 t70 -119.12 133.59 55.7 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.314 0.578 . . . . 0.0 111.353 -173.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.521 ' HE1' HD12 ' A' ' 10' ' ' ILE . 14.8 mmt -82.26 -19.88 38.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.081 176.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.69 -162.42 15.63 Favored Glycine 0 N--CA 1.44 -1.055 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.011 177.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.543 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 91.1 m95 -95.1 111.72 23.51 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.414 0.626 . . . . 0.0 110.906 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.88 HD12 HG12 ' A' ' 60' ' ' ILE . 2.0 pp -108.71 156.92 19.04 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.483 177.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.475 ' HB2' ' OG1' ' A' ' 59' ' ' THR . 17.6 mp0 -81.76 144.89 30.77 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -64.92 136.5 56.9 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.04 8.06 6.5 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 124.298 0.999 . . . . 0.0 112.731 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.475 ' OG1' ' HB2' ' A' ' 56' ' ' GLU . 62.2 p -111.39 6.07 20.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.093 0.949 . . . . 0.0 108.676 166.863 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.88 HG12 HD12 ' A' ' 55' ' ' LEU . 13.5 mt -69.47 141.02 90.32 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.381 -175.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.04 142.45 97.34 Favored 'Trans proline' 0 C--O 1.237 0.432 0 C-N-CA 122.232 1.954 . . . . 0.0 110.898 172.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.416 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 1.7 m-20 -55.04 -29.9 58.42 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.857 -169.762 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.516 ' HA ' ' ND2' ' A' ' 66' ' ' ASN . 35.0 tt0 -65.56 -36.41 83.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.863 0.363 . . . . 0.0 111.106 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.2 mp -83.66 -25.84 30.37 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.499 -0.48 . . . . 0.0 111.047 178.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.452 ' CG ' ' HB ' ' A' ' 60' ' ' ILE . 52.2 mtmt -73.86 -27.38 61.05 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 177.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . 0.516 ' ND2' ' HA ' ' A' ' 63' ' ' GLU . 3.2 p30 -84.5 -5.78 59.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.064 0.459 . . . . 0.0 110.054 176.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.975 ' HB2' HG13 ' A' ' 88' ' ' VAL . . . -68.21 -28.45 67.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.697 -178.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.39 23.05 45.26 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.979 -0.629 . . . . 0.0 113.315 176.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.627 ' HB3' ' CD1' ' A' ' 90' ' ' LEU . 11.1 mt -101.98 109.57 21.33 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.473 ' HA ' ' HD2' ' A' ' 70' ' ' LYS . 15.2 tptp -102.66 -60.1 1.6 Allowed 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 119.671 -0.812 . . . . 0.0 111.996 171.548 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.662 ' O ' HD12 ' A' ' 90' ' ' LEU . 25.5 mt-10 -107.81 152.03 24.94 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.268 0.556 . . . . 0.0 112.374 -169.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.676 ' HB2' HG12 ' A' ' 93' ' ' ILE . 35.6 tttp -66.4 138.31 57.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.125 -0.943 . . . . 0.0 112.207 -167.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.94 -9.62 37.1 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.875 -0.678 . . . . 0.0 111.804 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.404 ' HB3' HD13 ' A' ' 90' ' ' LEU . 9.8 tt0 -91.25 114.89 27.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.029 0.442 . . . . 0.0 109.936 175.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.574 HD12 ' HB2' ' A' ' 26' ' ' LEU . 2.4 pt? -143.12 170.08 16.38 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.963 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.689 ' HB2' HD12 ' A' ' 26' ' ' LEU . 23.7 t 78.15 45.71 0.06 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 124.164 0.915 . . . . 0.0 110.159 -172.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -92.89 104.42 3.18 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 171.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 25.4 t -90.51 113.04 25.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -176.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.624 HD11 ' HA ' ' A' ' 67' ' ' ALA . 41.1 mm -103.21 114.2 42.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.81 -176.095 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.55 ' HG2' ' HE1' ' A' ' 85' ' ' PHE . 4.5 tmtm? -72.02 113.43 9.04 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.108 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 35.5 t -119.05 161.45 20.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.446 -176.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.6 m -65.94 -26.39 67.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.827 177.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 35.6 m -92.79 -5.77 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.746 -178.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.66 -129.65 3.77 Favored Glycine 0 CA--C 1.508 -0.378 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 -176.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.55 ' HE1' ' HG2' ' A' ' 80' ' ' LYS . 97.0 m-85 -134.05 135.26 43.21 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.058 0.456 . . . . 0.0 110.613 177.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.628 HD13 ' HB ' ' A' ' 10' ' ' ILE . 50.5 tp -106.15 135.33 47.81 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.351 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.683 ' HB ' HG12 ' A' ' 11' ' ' ILE . 27.5 mm -105.7 118.6 53.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 178.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.975 HG13 ' HB2' ' A' ' 67' ' ' ALA . 10.7 p -103.82 136.92 34.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-O 121.319 0.581 . . . . 0.0 109.902 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.531 ' HG3' ' CD2' ' A' ' 32' ' ' PHE . 2.4 tmm_? -137.74 119.13 14.73 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.286 -173.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.662 HD12 ' O ' ' A' ' 71' ' ' GLU . 8.4 mt -77.6 109.0 11.19 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.398 176.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.56 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 32.2 t70 -79.59 -54.18 6.13 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 119.824 -0.751 . . . . 0.0 111.533 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.543 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 5.0 t70 -155.5 170.11 22.71 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.164 -177.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.676 HG12 ' HB2' ' A' ' 72' ' ' LYS . 32.7 mm -135.44 128.74 48.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.384 -178.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.663 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . 47.5 mt-30 -119.31 118.67 31.86 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 172.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.52 75.97 10.1 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.44 0.638 . . . . 0.0 109.86 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.52 136.64 58.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.219 -178.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . 0.512 ' HB2' ' HB2' ' A' ' 2' ' ' GLN . 85.3 t60 75.35 115.4 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.282 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -145.73 -44.81 0.21 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.582 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -176.29 -72.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.364 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -112.89 -20.67 11.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.679 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -66.06 -39.51 90.14 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.311 0.577 . . . . 0.0 109.687 174.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.487 ' HB3' ' H ' ' A' ' 97' ' ' HIS . 3.5 t-160 . . . . . 0 C--O 1.246 0.897 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 178.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 28.0 m . . . . . 0 N--CA 1.476 0.837 0 CA-C-O 120.807 0.337 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.705 HE21 ' HD2' ' A' ' 3' ' ' PRO . 0.5 OUTLIER -90.3 135.06 30.14 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-O 121.722 0.772 . . . . 0.0 111.713 -177.379 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.705 ' HD2' HE21 ' A' ' 2' ' ' GLN . 94.4 Cg_endo -78.78 151.41 24.72 Favored 'Trans proline' 0 C--N 1.33 -0.425 0 C-N-CA 124.211 3.274 . . . . 0.0 111.723 176.403 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -69.41 157.16 37.61 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.507 ' HG2' ' HA ' ' A' ' 56' ' ' GLU . 99.9 mtt180 -130.17 151.11 51.05 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.998 0.428 . . . . 0.0 110.448 -176.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.809 HG21 HG13 ' A' ' 93' ' ' ILE . 30.7 m -136.82 137.17 39.48 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.504 -178.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.551 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 62.9 ttt180 -96.95 111.83 23.86 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.345 -0.389 . . . . 0.0 109.953 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -109.79 138.32 46.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.103 0.477 . . . . 0.0 111.308 -179.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.526 ' HB2' ' CG ' ' A' ' 89' ' ' ARG . 6.5 m -112.31 132.71 54.82 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 172.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.585 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.7 pp -137.77 144.29 31.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 110.541 -0.17 . . . . 0.0 110.541 -176.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.633 HD12 HG13 ' A' ' 22' ' ' VAL . 6.1 pt -140.43 146.95 23.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 174.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -97.66 126.57 43.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.898 0.38 . . . . 0.0 110.828 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.691 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 12.9 p -103.03 140.37 37.37 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.475 177.411 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -64.65 -32.2 73.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.783 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.417 HG22 ' H ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -150.9 171.71 16.82 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.54 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.655 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 33.8 tt0 -62.2 -36.25 81.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.246 0.546 . . . . 0.0 109.633 -179.116 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -53.89 -40.31 66.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.667 177.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.691 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 8.6 mm-40 -69.14 -41.2 77.62 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.776 -179.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.545 ' HA ' HG23 ' A' ' 13' ' ' THR . . . -59.18 -44.85 92.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.327 177.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.655 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.3 mmtp -55.89 -48.0 76.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.291 176.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.06 -33.07 73.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.108 0.48 . . . . 0.0 110.972 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.633 HG13 HD12 ' A' ' 11' ' ' ILE . 79.4 t -73.73 -50.37 29.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.25 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.816 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -68.17 -30.53 69.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.138 -176.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.457 ' N ' HD11 ' A' ' 23' ' ' LEU . 12.8 t70 -64.3 -41.23 96.97 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.1 0.476 . . . . 0.0 110.235 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -76.07 -39.07 56.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.186 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.816 ' HG ' ' HA ' ' A' ' 23' ' ' LEU . 4.1 pp -71.87 -13.87 61.79 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.159 177.45 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.454 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 0.5 OUTLIER -62.91 -33.14 74.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.987 172.675 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -71.92 -29.75 64.63 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 121.605 0.717 . . . . 0.0 109.371 172.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.75 29.7 46.72 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.03 -0.987 . . . . 0.0 112.334 178.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.84 -63.2 1.28 Allowed Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 119.377 -1.392 . . . . 0.0 113.326 -175.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.414 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 9.4 t0 -139.28 115.72 10.55 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 117.241 0.521 . . . . 0.0 111.86 178.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.487 ' HA ' HD11 ' A' ' 35' ' ' LEU . 73.3 t80 -84.89 -41.07 16.32 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.791 0.329 . . . . 0.0 110.816 172.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.43 -33.47 65.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.111 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.79 -44.52 85.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.091 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.487 HD11 ' HA ' ' A' ' 32' ' ' PHE . 12.9 mt -62.54 -37.26 85.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.395 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.532 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -62.52 -48.28 80.23 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.351 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.659 ' HA ' HG21 ' A' ' 43' ' ' ILE . 54.8 mtpt -79.1 -33.86 44.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.124 -173.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -79.81 -55.68 4.81 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -177.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.858 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -97.85 -24.54 15.38 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.664 0.745 . . . . 0.0 112.919 -168.303 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.532 ' HB3' ' O ' ' A' ' 36' ' ' ALA . 43.2 t -89.6 152.29 21.47 Favored 'General case' 0 C--N 1.291 -1.953 0 O-C-N 121.133 -0.979 . . . . 0.0 113.008 -167.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.38 0.93 39.65 Favored 'General case' 0 C--N 1.334 -0.069 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.102 172.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.451 ' HB3' ' HB1' ' A' ' 46' ' ' ALA . 20.2 t70 -65.07 -15.99 62.97 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.501 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.847 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.6 pp -55.39 -16.35 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -157.634 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.464 ' N ' HD12 ' A' ' 43' ' ' ILE . 77.7 mt -51.76 -43.11 33.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.258 0.551 . . . . 0.0 109.603 167.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.9 m -109.41 -25.56 10.46 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.139 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.847 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -50.96 -29.0 11.05 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -174.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -53.74 -24.5 15.12 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -89.4 10.65 21.76 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.033 0.445 . . . . 0.0 110.898 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.22 22.83 31.15 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.359 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 62.21 29.19 72.26 Favored Glycine 0 C--N 1.331 0.284 0 N-CA-C 111.679 -0.568 . . . . 0.0 111.679 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -90.56 113.58 25.62 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.289 0.566 . . . . 0.0 111.226 -172.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 96.7 mmm -75.51 -19.22 59.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.111 177.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 100.15 -149.11 18.64 Favored Glycine 0 N--CA 1.437 -1.253 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.641 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.636 ' CZ3' ' HG2' ' A' ' 94' ' ' GLN . 86.7 m95 -109.3 111.82 23.61 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.23 0.538 . . . . 0.0 111.212 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.468 ' O ' HD12 ' A' ' 55' ' ' LEU . 1.4 pp -99.0 153.12 19.1 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.679 174.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.507 ' HA ' ' HG2' ' A' ' 5' ' ' ARG . 21.7 mt-10 -90.51 140.28 29.88 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -67.39 149.56 50.12 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.121 -178.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.32 7.42 6.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.065 -175.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.8 p -112.18 3.91 17.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.717 0.77 . . . . 0.0 109.116 167.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.502 ' HB ' ' HD3' ' A' ' 65' ' ' LYS . 22.2 mt -87.13 136.17 34.12 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.049 -169.452 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.53 139.47 81.9 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.265 1.977 . . . . 0.0 110.718 171.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.61 -23.86 59.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.136 -172.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -54.01 -47.58 71.34 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.161 0.288 . . . . 0.0 110.892 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 mp -83.33 -23.15 32.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.636 0.255 . . . . 0.0 111.381 -178.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.502 ' HD3' ' HB ' ' A' ' 60' ' ' ILE . 32.1 mmmt -69.83 -37.53 76.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.009 0.433 . . . . 0.0 110.22 176.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -80.19 -5.27 55.81 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.219 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.792 ' HB1' HG12 ' A' ' 88' ' ' VAL . . . -57.69 -25.13 59.86 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.856 0.36 . . . . 0.0 111.918 -179.493 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.86 19.9 66.72 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.313 177.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.665 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 15.3 mt -95.43 94.12 7.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.186 0.517 . . . . 0.0 111.678 -175.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -101.22 -47.84 4.59 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.936 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.437 ' O ' HD11 ' A' ' 90' ' ' LEU . 35.6 mm-40 -84.74 129.75 34.78 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.078 -171.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.607 ' HE2' ' HA ' ' A' ' 92' ' ' ASP . 63.3 tttm -66.31 117.66 8.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.103 0.478 . . . . 0.0 111.073 -174.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 102.67 -1.16 48.99 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.653 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.54 126.63 30.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.788 ' HB3' HD12 ' A' ' 26' ' ' LEU . 62.8 mt -116.54 166.08 12.5 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.819 -174.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.509 ' HB2' HD11 ' A' ' 26' ' ' LEU . 12.5 t 76.33 57.82 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.877 0.846 . . . . 0.0 111.106 168.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.426 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -102.4 103.84 2.51 Favored Glycine 0 N--CA 1.439 -1.14 0 N-CA-C 110.146 -1.182 . . . . 0.0 110.146 169.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 26.3 t -98.97 113.06 32.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.152 0.501 . . . . 0.0 109.77 -175.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.43 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 79.2 mt -102.29 116.97 46.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.86 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -86.76 127.11 34.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.357 0.599 . . . . 0.0 111.471 -177.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.5 m -128.91 155.2 45.66 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.014 174.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.4 m -59.84 -27.15 66.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.949 0.404 . . . . 0.0 111.424 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 10.0 p -87.23 -17.82 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.477 -177.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 158.86 -171.19 35.45 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.964 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -112.06 140.67 46.55 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.754 0.311 . . . . 0.0 110.904 -176.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.446 HD11 ' HB ' ' A' ' 10' ' ' ILE . 34.1 tp -113.24 135.76 53.48 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.412 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.592 ' HB ' HG12 ' A' ' 11' ' ' ILE . 24.2 mm -104.7 130.69 55.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 177.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.792 HG12 ' HB1' ' A' ' 67' ' ' ALA . 13.6 p -125.18 140.76 47.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -177.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.681 ' NH2' ' HA ' ' A' ' 91' ' ' ASP . 0.2 OUTLIER -142.14 158.7 43.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.327 0.584 . . . . 0.0 110.862 177.023 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.935 HD22 HD12 ' A' ' 93' ' ' ILE . 10.8 mt -99.95 108.86 21.18 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.479 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.681 ' HA ' ' NH2' ' A' ' 89' ' ' ARG . 19.0 t70 -81.07 -54.08 5.85 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.322 -0.551 . . . . 0.0 111.826 177.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.607 ' HA ' ' HE2' ' A' ' 72' ' ' LYS . 9.1 t70 -155.98 152.99 28.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.458 -177.243 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.935 HD12 HD22 ' A' ' 90' ' ' LEU . 4.7 mp -133.1 128.32 55.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.636 ' HG2' ' CZ3' ' A' ' 54' ' ' TRP . 25.4 pt20 -132.21 129.28 39.49 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.264 0.555 . . . . 0.0 110.993 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.02 45.42 1.17 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.583 177.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.498 ' HB2' ' HG2' ' A' ' 2' ' ' GLN . . . 63.23 -162.27 0.28 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.212 -0.903 . . . . 0.0 111.601 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 15.3 m-70 -94.31 -99.71 0.15 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 41.5 t60 62.35 -72.7 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.715 0.806 . . . . 0.0 111.647 179.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 38.0 t60 -153.96 -14.53 0.14 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.011 0.434 . . . . 0.0 109.886 178.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 63.1 m80 -77.72 149.35 34.58 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.995 -177.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -75.82 97.07 3.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.194 0.521 . . . . 0.0 110.4 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 51.2 p-80 . . . . . 0 C--O 1.248 0.987 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.067 178.406 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 31.5 m . . . . . 0 N--CA 1.476 0.852 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.448 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 76.4 mt-30 -71.58 124.83 91.54 Favored Pre-proline 0 CA--C 1.515 -0.37 0 CA-C-O 121.128 0.49 . . . . 0.0 111.331 -178.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 2' ' ' GLN . 93.9 Cg_endo -92.3 150.08 3.04 Favored 'Trans proline' 0 N--CA 1.446 -1.291 0 C-N-CA 123.791 2.994 . . . . 0.0 110.509 175.115 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.601 ' HB2' ' HB1' ' A' ' 96' ' ' ALA . 10.1 pt20 -71.12 148.89 46.98 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.57 ' HG3' ' HB2' ' A' ' 94' ' ' GLN . 25.0 ptt180 -122.35 129.8 52.48 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.355 0.598 . . . . 0.0 109.9 176.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.56 HG21 HG22 ' A' ' 93' ' ' ILE . 20.6 m -120.27 141.39 50.03 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.056 -0.975 . . . . 0.0 109.987 -174.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.619 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 66.0 ttt180 -95.02 111.0 22.85 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 120.071 -0.652 . . . . 0.0 109.249 177.034 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.4 ' HE2' HD13 ' A' ' 60' ' ' ILE . 15.2 m-85 -106.91 135.08 49.07 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.381 0.61 . . . . 0.0 111.239 -178.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.563 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 20.4 m -112.36 134.82 53.69 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.272 -0.876 . . . . 0.0 108.846 169.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.639 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.8 pp -139.59 143.06 31.46 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -177.125 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.716 ' HA ' ' HB2' ' A' ' 42' ' ' ASP . 1.1 pt -138.04 141.76 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -96.8 117.35 30.89 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -179.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.605 HG22 ' HE3' ' A' ' 39' ' ' LYS . 2.5 p -94.36 147.88 22.78 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.384 0.612 . . . . 0.0 110.916 -175.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.621 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 10.8 mmmm -64.77 -33.85 76.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.649 -171.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.425 ' HG1' ' C ' ' A' ' 14' ' ' LYS . 10.4 m -157.36 171.16 20.89 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 29.5 tt0 -57.63 -35.4 70.44 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.248 0.547 . . . . 0.0 110.323 -179.205 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -54.0 -43.11 69.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.497 176.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.621 ' HG3' ' HB2' ' A' ' 14' ' ' LYS . 8.1 mm-40 -64.32 -42.4 96.34 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.39 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.546 ' HB3' HD13 ' A' ' 87' ' ' ILE . . . -62.07 -46.39 89.35 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.975 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.601 ' HD3' HD23 ' A' ' 23' ' ' LEU . 30.0 mmtp -60.43 -39.67 88.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.971 178.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.19 -31.57 72.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.008 0.432 . . . . 0.0 110.871 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.617 HG23 ' O ' ' A' ' 18' ' ' GLU . 81.4 t -72.92 -50.58 31.69 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.865 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.618 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.2 pp -65.72 -27.64 68.47 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.336 -176.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.409 ' N ' HD11 ' A' ' 23' ' ' LEU . 9.7 t70 -64.1 -53.52 48.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.003 0.43 . . . . 0.0 110.302 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.448 ' HG2' HD23 ' A' ' 35' ' ' LEU . 1.5 tp10 -66.37 -41.4 89.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.976 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.909 HD11 ' HB2' ' A' ' 76' ' ' SER . 3.8 pp -73.08 -16.67 61.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.012 -179.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.427 ' N ' HD13 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -71.38 -30.68 66.41 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 175.129 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -76.02 -32.6 59.46 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 169.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 80.62 36.37 23.14 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.518 -1.219 . . . . 0.0 113.749 168.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -85.38 -63.73 1.55 Allowed Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 118.871 -1.633 . . . . 0.0 112.404 -178.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -139.95 121.23 14.92 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.824 0.312 . . . . 0.0 110.93 173.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -84.51 -32.06 24.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.095 0.474 . . . . 0.0 110.3 174.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.65 -35.98 71.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.087 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.32 -36.22 78.98 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.353 0.597 . . . . 0.0 110.289 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.448 HD23 ' HG2' ' A' ' 25' ' ' GLU . 6.6 mt -69.56 -32.92 71.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.242 -178.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.543 ' HB3' HG21 ' A' ' 11' ' ' ILE . . . -71.23 -46.2 61.6 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.562 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.7 mtpt -77.76 -28.75 50.68 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -168.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -79.34 -61.8 1.89 Allowed 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -169.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.605 ' HE3' HG22 ' A' ' 13' ' ' THR . 0.0 OUTLIER -104.16 -21.99 13.47 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 -179.903 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.516 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 10.4 m -75.21 143.73 43.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.205 0.526 . . . . 0.0 111.53 -168.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -76.84 5.84 7.13 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.778 -177.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.716 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 18.9 t70 -64.03 -16.26 61.27 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.243 -1.344 . . . . 0.0 111.767 176.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.867 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.6 pp -55.83 -15.51 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 -159.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.417 ' N ' HD12 ' A' ' 43' ' ' ILE . 66.5 mt -58.11 -44.14 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-O 121.096 0.474 . . . . 0.0 109.849 167.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -109.65 -13.84 14.45 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.931 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.867 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -53.3 -29.07 31.46 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 122.765 0.426 . . . . 0.0 111.777 178.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -55.08 -19.4 7.23 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.513 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.9 m-20 -89.96 0.22 57.21 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.84 0.352 . . . . 0.0 110.614 177.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.47 29.31 14.37 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.131 -0.787 . . . . 0.0 111.131 -173.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.531 ' HA2' ' OD2' ' A' ' 42' ' ' ASP . . . 80.36 -2.64 76.38 Favored Glycine 0 N--CA 1.453 -0.222 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -175.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -73.86 122.23 22.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.101 0.477 . . . . 0.0 111.846 -175.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.466 ' SD ' HG12 ' A' ' 10' ' ' ILE . 87.6 mtp -78.1 -34.46 50.13 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.149 172.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 120.15 -172.14 14.8 Favored Glycine 0 N--CA 1.438 -1.19 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.186 -174.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.527 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 94.6 m95 -89.68 120.71 31.19 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 120.824 0.345 . . . . 0.0 111.078 178.525 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.481 HD21 ' O ' ' A' ' 55' ' ' LEU . 0.6 OUTLIER -115.7 155.37 27.85 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 174.644 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -88.5 139.57 30.34 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 120.967 0.413 . . . . 0.0 109.924 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -56.96 151.32 15.02 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.337 173.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 72.5 7.11 5.58 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 124.319 1.012 . . . . 0.0 110.943 -172.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.2 m -111.53 -0.25 16.23 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 162.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.69 ' HB ' ' HE2' ' A' ' 65' ' ' LYS . 56.6 mt -88.39 115.59 63.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.62 -176.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.26 157.66 58.87 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.166 2.577 . . . . 0.0 111.65 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.613 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . 4.7 m-20 -56.79 -20.96 25.23 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.915 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.47 -52.64 64.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.478 175.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.415 ' O ' ' HB1' ' A' ' 67' ' ' ALA . 6.3 mp -82.93 -14.23 54.54 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.929 0.395 . . . . 0.0 110.708 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.69 ' HE2' ' HB ' ' A' ' 60' ' ' ILE . 72.2 mmtt -73.3 -34.4 65.71 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 172.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 -75.15 -5.8 46.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.736 174.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.961 ' HB3' HG12 ' A' ' 88' ' ' VAL . . . -74.43 -32.25 62.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.202 175.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 73.8 21.55 79.17 Favored Glycine 0 C--N 1.336 0.529 0 CA-C-N 115.393 -0.821 . . . . 0.0 113.016 176.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.671 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 12.4 mt -86.41 94.64 9.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.071 0.463 . . . . 0.0 111.396 -177.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -100.29 -54.73 2.79 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.308 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.525 ' O ' HD11 ' A' ' 90' ' ' LEU . 36.8 mt-10 -106.92 142.88 35.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.12 0.486 . . . . 0.0 111.56 -172.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.56 ' CD ' ' HA ' ' A' ' 92' ' ' ASP . 28.0 ttpp -66.74 137.12 56.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.702 -168.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.1 -6.28 36.82 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.586 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.581 ' HB3' HD12 ' A' ' 90' ' ' LEU . 8.2 tt0 -91.65 116.41 28.85 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.53 0.681 . . . . 0.0 110.034 176.396 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.672 ' HG ' HD12 ' A' ' 26' ' ' LEU . 2.1 pt? -139.53 169.81 17.07 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.909 ' HB2' HD11 ' A' ' 26' ' ' LEU . 37.1 t 78.87 59.98 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 122.288 1.042 . . . . 0.0 109.877 -167.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -111.7 108.6 2.33 Favored Glycine 0 N--CA 1.439 -1.103 0 CA-C-N 114.192 -1.367 . . . . 0.0 109.79 168.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 37.4 t -92.11 113.6 27.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.0 0.429 . . . . 0.0 110.415 -173.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.53 HD11 ' HB2' ' A' ' 67' ' ' ALA . 71.3 mt -106.87 122.13 60.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.828 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 58.2 tttp -85.54 128.99 34.92 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.216 0.532 . . . . 0.0 110.794 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.2 m -118.66 161.51 19.96 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 174.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 26.2 t -69.58 -28.56 66.07 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.184 0.516 . . . . 0.0 109.707 176.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 10.7 p -84.33 -12.95 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.607 -177.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 157.94 -139.22 6.22 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.749 -0.738 . . . . 0.0 111.77 -177.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -131.16 149.38 52.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 117.048 0.424 . . . . 0.0 111.075 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.598 HD11 ' HB ' ' A' ' 10' ' ' ILE . 40.3 tp -121.41 135.46 55.06 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.15 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.639 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 28.9 mm -109.97 126.37 67.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.878 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.961 HG12 ' HB3' ' A' ' 67' ' ' ALA . 7.1 p -108.3 141.87 22.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 121.102 0.477 . . . . 0.0 110.497 -177.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.563 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 1.5 tmm_? -141.21 122.04 14.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.529 -175.326 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.671 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 9.8 mt -77.7 108.82 11.18 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.842 176.348 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.619 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 34.3 t70 -80.8 -54.17 5.84 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 119.32 -0.952 . . . . 0.0 111.54 175.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.56 ' HA ' ' CD ' ' A' ' 72' ' ' LYS . 2.7 t70 -156.47 170.69 21.74 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.71 -177.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.56 HG22 HG21 ' A' ' 6' ' ' THR . 0.4 OUTLIER -137.48 136.84 46.27 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-O 121.086 0.47 . . . . 0.0 110.976 175.827 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.57 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . 19.0 mt-30 -127.05 127.5 44.82 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.554 178.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.573 ' HA ' ' CE1' ' A' ' 99' ' ' HIS . . . 70.61 20.15 5.87 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.204 176.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.601 ' HB1' ' HB2' ' A' ' 4' ' ' GLN . . . -110.97 115.89 30.26 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.752 -176.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 74.87 -44.36 0.54 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 166.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -59.32 -56.15 25.77 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -168.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.573 ' CE1' ' HA ' ' A' ' 95' ' ' ALA . 12.3 p-80 -98.38 -0.25 44.05 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.652 -178.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -163.32 122.01 2.03 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.317 -0.624 . . . . 0.0 109.317 176.601 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 8.4 p80 -60.23 124.29 19.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.568 0.699 . . . . 0.0 110.833 -175.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 . . . . . 0 C--N 1.316 -0.865 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.251 179.675 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 2.8 t . . . . . 0 N--CA 1.477 0.891 0 CA-C-O 121.348 0.594 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -117.22 146.38 38.05 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.2 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -86.07 126.15 2.78 Favored 'Trans proline' 0 N--CA 1.448 -1.182 0 C-N-CA 122.506 2.138 . . . . 0.0 110.841 175.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.449 ' HB2' ' HA ' ' A' ' 95' ' ' ALA . 30.0 pt20 -70.03 155.44 40.59 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -113.95 138.54 50.21 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 120.622 -0.431 . . . . 0.0 109.923 -175.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.685 HG21 HG13 ' A' ' 93' ' ' ILE . 10.8 m -120.75 137.77 54.34 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.335 -178.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.417 ' HB2' ' CE2' ' A' ' 54' ' ' TRP . 67.8 ttt180 -101.85 111.96 24.41 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.712 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.641 ' HD2' HD23 ' A' ' 55' ' ' LEU . 17.7 m-85 -107.03 133.45 51.66 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.673 -177.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.522 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 2.6 m -98.28 132.54 43.68 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 168.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.678 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.24 147.04 21.75 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -177.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.737 ' HB ' ' HG ' ' A' ' 40' ' ' SER . 3.3 pt -138.16 142.47 35.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 C-N-CA 120.423 -0.511 . . . . 0.0 109.71 177.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -97.49 115.52 27.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.094 0.473 . . . . 0.0 110.006 -177.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.405 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 77.3 p -99.01 148.93 23.5 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.398 -177.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -69.23 -34.23 74.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.77 -174.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -152.41 174.76 13.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.998 0.427 . . . . 0.0 111.923 -178.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -65.48 -26.46 67.94 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.56 -45.21 92.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.295 177.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.568 ' OE1' ' HG3' ' A' ' 39' ' ' LYS . 81.3 mm-40 -65.78 -44.86 84.49 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.635 176.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . 0.583 ' HA ' HD11 ' A' ' 87' ' ' ILE . . . -56.41 -48.04 77.76 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.427 -176.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.47 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 1.5 mptm? -64.21 -33.54 76.04 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.17 -41.5 70.27 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.085 0.469 . . . . 0.0 110.418 177.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.703 HG11 HD23 ' A' ' 26' ' ' LEU . 93.0 t -71.51 -49.17 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.368 -178.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.584 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.5 pp -63.01 -28.56 70.19 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.031 -176.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.459 ' N ' HD11 ' A' ' 23' ' ' LEU . 9.1 t70 -65.88 -48.81 70.27 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.174 0.511 . . . . 0.0 109.952 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.445 ' HG2' HD22 ' A' ' 35' ' ' LEU . 6.6 tp10 -66.24 -43.98 85.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.679 -178.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.703 HD23 HG11 ' A' ' 22' ' ' VAL . 4.3 pp -73.43 -19.04 61.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.105 -178.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -75.0 -24.88 58.47 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.882 0.372 . . . . 0.0 110.45 176.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -71.92 -24.23 61.6 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 170.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.72 25.84 52.07 Favored Glycine 0 N--CA 1.443 -0.849 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.517 175.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.21 -63.6 1.25 Allowed Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 119.154 -1.498 . . . . 0.0 113.061 -176.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -140.07 114.81 9.47 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.255 0.528 . . . . 0.0 111.604 177.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.553 ' HA ' HD13 ' A' ' 35' ' ' LEU . 60.2 t80 -86.78 -41.34 14.17 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.325 0.583 . . . . 0.0 109.874 170.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.648 ' O ' ' HG2' ' A' ' 37' ' ' LYS . . . -58.61 -35.44 72.46 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.221 -176.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.04 -38.42 88.34 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.49 0.662 . . . . 0.0 110.355 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.599 ' HB3' HG13 ' A' ' 22' ' ' VAL . 11.6 mt -65.32 -36.21 83.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.301 178.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.645 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -67.41 -41.24 85.2 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.612 -1.176 . . . . 0.0 111.126 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.648 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 13.5 mmmm -69.62 -46.37 66.39 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.655 -173.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -59.35 2.75 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 -166.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.568 ' HG3' ' OE1' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -100.27 -21.87 15.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.109 -174.692 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.737 ' HG ' ' HB ' ' A' ' 11' ' ' ILE . 35.4 t -69.08 146.38 52.63 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 120.839 0.352 . . . . 0.0 111.515 -171.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.41 0.1 43.62 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.837 0.827 . . . . 0.0 109.931 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.588 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 38.6 t70 -66.54 -16.07 63.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.329 -1.305 . . . . 0.0 112.428 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.864 ' HA ' ' HB2' ' A' ' 46' ' ' ALA . 2.8 pp -55.16 -16.61 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -150.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 65.8 mt -61.97 -39.84 85.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 118.421 0.555 . . . . 0.0 109.646 169.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m -92.2 -30.88 15.69 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.322 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.864 ' HB2' ' HA ' ' A' ' 43' ' ' ILE . . . -52.63 -29.53 26.63 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.335 -176.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -53.58 -30.98 44.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.044 0.449 . . . . 0.0 110.941 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -90.99 9.9 28.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.225 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.28 24.71 28.28 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.586 -177.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.447 ' HA2' ' OD2' ' A' ' 42' ' ' ASP . . . 83.86 8.44 84.28 Favored Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 -176.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -72.34 108.74 5.62 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.214 0.531 . . . . 0.0 111.39 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.403 ' HE3' ' HB3' ' A' ' 52' ' ' MET . 54.2 mmm -82.48 -24.06 34.39 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.753 176.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 130.07 -160.36 22.9 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.036 -175.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.637 ' CH2' ' HG2' ' A' ' 94' ' ' GLN . 81.0 m95 -107.72 138.52 43.8 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.886 0.374 . . . . 0.0 110.993 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.641 HD23 ' HD2' ' A' ' 8' ' ' TYR . 3.5 pp -126.24 156.18 40.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.208 176.053 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -82.2 130.51 35.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.077 0.465 . . . . 0.0 110.455 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -70.29 147.05 50.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.165 178.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 71.65 7.24 5.91 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 124.34 1.025 . . . . 0.0 111.788 -176.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.1 p -111.7 2.1 17.04 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 166.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.573 ' HB ' ' HE3' ' A' ' 65' ' ' LYS . 45.6 mt -69.72 128.46 91.97 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 114.215 -1.357 . . . . 0.0 111.257 -173.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.98 157.01 61.57 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 122.833 2.356 . . . . 0.0 111.445 174.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.515 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . 7.4 p-10 -56.68 -21.37 27.19 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.601 -172.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.677 ' HG3' HG21 ' A' ' 79' ' ' ILE . 39.4 tt0 -56.29 -56.59 19.22 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.087 0.242 . . . . 0.0 110.614 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 4.8 mp -83.72 -16.62 44.2 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.504 -178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.573 ' HE3' ' HB ' ' A' ' 60' ' ' ILE . 31.8 mmtp -60.13 -35.29 74.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.217 0.532 . . . . 0.0 110.435 174.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -78.3 -5.82 53.22 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.772 -178.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.79 -32.24 46.31 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.195 0.521 . . . . 0.0 110.419 177.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 68.98 22.09 75.67 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.326 -0.852 . . . . 0.0 113.339 176.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.708 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 6.6 mt -86.81 88.49 7.69 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.004 0.43 . . . . 0.0 111.707 -174.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.427 ' HA ' ' HD2' ' A' ' 70' ' ' LYS . 23.1 tptp -100.58 -39.98 7.63 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 178.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -95.94 128.35 42.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.955 -174.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.622 ' HB2' HD12 ' A' ' 93' ' ' ILE . 82.6 tttt -66.58 134.73 52.95 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.151 0.501 . . . . 0.0 111.044 -172.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.13 -1.63 35.28 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.538 -177.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -92.16 130.77 37.8 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.166 0.507 . . . . 0.0 110.554 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.481 ' HB3' HD11 ' A' ' 26' ' ' LEU . 2.1 mp -118.82 169.77 9.57 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.691 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.2 t 78.98 60.95 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.797 0.808 . . . . 0.0 112.593 169.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -109.21 102.84 1.7 Allowed Glycine 0 N--CA 1.443 -0.849 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 163.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 19.9 t -100.46 113.88 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.482 0 CA-C-O 121.004 0.43 . . . . 0.0 110.007 -177.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.677 HG21 ' HG3' ' A' ' 63' ' ' GLU . 51.5 mm -109.62 127.01 66.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.7 -177.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -77.6 125.31 29.14 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.379 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.0 m -119.9 163.79 17.02 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.029 178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.2 m -68.91 -26.4 65.07 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.25 0.548 . . . . 0.0 110.262 177.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 14.7 p -84.1 -12.54 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.238 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.7 -133.06 4.14 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.007 -0.616 . . . . 0.0 111.786 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -130.1 139.41 50.94 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.658 0.265 . . . . 0.0 110.511 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.678 HD11 ' HB ' ' A' ' 10' ' ' ILE . 29.9 tp -120.48 135.67 54.99 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -178.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.583 HD11 ' HA ' ' A' ' 19' ' ' ALA . 5.0 mt -119.23 125.88 74.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.553 HG22 HD13 ' A' ' 69' ' ' LEU . 1.8 m -113.16 145.9 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-O 121.486 0.66 . . . . 0.0 111.311 -174.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.548 ' HD3' ' CG ' ' A' ' 32' ' ' PHE . 34.3 ttp180 -134.58 145.86 49.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.196 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.834 HD21 HD11 ' A' ' 93' ' ' ILE . 14.6 mt -87.42 108.29 18.94 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.079 0.466 . . . . 0.0 111.284 179.605 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.477 ' O ' ' HE3' ' A' ' 72' ' ' LYS . 3.7 t0 -80.92 -53.76 6.17 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.897 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.403 ' C ' HD13 ' A' ' 93' ' ' ILE . 10.8 m-20 -154.51 160.36 41.51 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.113 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.834 HD11 HD21 ' A' ' 90' ' ' LEU . 3.4 mp -136.05 127.69 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 172.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.637 ' HG2' ' CH2' ' A' ' 54' ' ' TRP . 81.6 mm-40 -128.23 120.02 26.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.768 0.318 . . . . 0.0 110.36 177.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . 0.449 ' HA ' ' HB2' ' A' ' 4' ' ' GLN . . . -86.9 51.87 2.36 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.033 -179.311 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 56.08 85.06 0.08 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.188 -178.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 81.4 m-70 69.21 -142.98 0.09 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.657 -174.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 74.49 -47.17 0.63 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.974 0.909 . . . . 0.0 110.862 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -97.86 131.41 44.37 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 170.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 25.1 t-80 -76.58 71.95 3.22 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.991 0.424 . . . . 0.0 111.89 -171.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -161.12 24.28 0.13 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 172.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.095 -0.955 . . . . 0.0 109.83 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 56.0 p . . . . . 0 N--CA 1.477 0.907 0 CA-C-O 120.68 0.276 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLN . . . . . 0.413 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 79.8 mt-30 -72.92 124.37 90.64 Favored Pre-proline 0 N--CA 1.451 -0.399 0 CA-C-O 121.469 0.652 . . . . 0.0 111.443 -178.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.413 ' HD3' ' HA ' ' A' ' 2' ' ' GLN . 92.3 Cg_endo -91.66 109.61 0.29 Allowed 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 123.557 2.838 . . . . 0.0 111.73 177.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.645 ' HB2' ' HB2' ' A' ' 96' ' ' ALA . 15.6 pt20 -70.81 158.12 36.9 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 176.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -121.99 135.0 54.81 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 120.033 -0.667 . . . . 0.0 110.389 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.726 HG23 HG13 ' A' ' 93' ' ' ILE . 22.3 m -128.67 133.59 48.26 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.311 -177.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.616 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 34.1 ttt180 -95.44 111.47 23.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.64 ' HD2' HD23 ' A' ' 55' ' ' LEU . 14.7 m-85 -103.96 135.4 45.55 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.283 -178.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.659 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 0.7 OUTLIER -96.33 132.18 42.09 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 168.588 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.852 ' HB ' HD13 ' A' ' 86' ' ' LEU . 2.8 pp -142.7 141.38 27.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.61 HG12 ' HB ' ' A' ' 87' ' ' ILE . 5.6 pt -140.49 149.15 21.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -103.27 113.32 26.72 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.496 -174.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.788 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 16.1 p -94.66 141.83 28.16 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.261 178.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -64.55 -30.78 71.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.782 -174.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.31 173.67 14.21 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.525 ' HG2' ' HE2' ' A' ' 20' ' ' LYS . 32.2 tt0 -64.13 -36.58 84.5 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -53.05 -39.54 63.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.979 177.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.788 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 6.1 mm-40 -67.38 -37.1 82.61 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.776 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.83 -39.52 94.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.088 179.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.525 ' HE2' ' HG2' ' A' ' 16' ' ' GLU . 5.1 mptp? -55.55 -48.41 74.78 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.098 176.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.13 -31.05 72.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.961 0.41 . . . . 0.0 111.126 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.497 HG12 HD11 ' A' ' 11' ' ' ILE . 94.4 t -75.68 -51.91 19.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.074 179.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.465 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -66.64 -27.78 67.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.252 -176.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.449 ' N ' HD12 ' A' ' 23' ' ' LEU . 28.1 t70 -64.26 -46.72 82.49 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.759 0.314 . . . . 0.0 111.209 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.443 ' HB3' HD21 ' A' ' 35' ' ' LEU . 29.9 tt0 -75.35 -40.15 58.5 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.29 -176.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.741 HD12 HD12 ' A' ' 75' ' ' LEU . 2.8 pp -69.96 -13.66 62.34 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.661 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.436 ' N ' HD13 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -69.5 -21.03 63.71 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.95 174.551 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -88.99 -26.19 21.62 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 169.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.74 33.93 26.17 Favored Glycine 0 N--CA 1.449 -0.496 0 CA-C-N 114.609 -1.178 . . . . 0.0 113.397 170.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.67 -63.41 1.48 Allowed Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 119.025 -1.559 . . . . 0.0 112.839 -176.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.527 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 3.0 m-20 -139.48 116.65 11.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.883 0.342 . . . . 0.0 111.613 177.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.514 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 43.3 t80 -81.71 -37.87 26.66 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 169.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.49 -37.72 65.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.834 176.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.72 -39.13 84.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.581 -178.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 31' ' ' ASP . 11.4 mt -66.99 -43.04 83.99 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.196 177.729 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.459 ' HB2' ' HB3' ' A' ' 46' ' ' ALA . . . -59.28 -53.29 59.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.394 -1.276 . . . . 0.0 111.892 -177.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.448 ' HA ' HG22 ' A' ' 43' ' ' ILE . 40.2 mtpt -75.66 -29.5 59.1 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.906 -169.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -79.92 -56.03 4.55 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.826 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 1.2 tppp? -97.66 -24.74 15.37 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -163.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.61 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 24.7 p -92.17 156.56 17.25 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.024 -1.048 . . . . 0.0 112.387 -165.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.98 6.07 19.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.335 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.46 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 13.1 t70 -75.27 -15.24 60.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.051 -0.977 . . . . 0.0 112.218 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.847 ' HA ' ' HB1' ' A' ' 46' ' ' ALA . 2.7 pp -55.8 -15.98 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -152.186 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.475 ' N ' HD13 ' A' ' 43' ' ' ILE . 58.3 mt -53.93 -37.56 34.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 118.427 0.558 . . . . 0.0 109.748 169.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 p -107.72 -25.09 11.45 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.483 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.847 ' HB1' ' HA ' ' A' ' 43' ' ' ILE . . . -56.65 -29.21 62.01 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 178.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.527 ' HG3' ' O ' ' A' ' 43' ' ' ILE . 99.2 mtt180 -57.87 -15.84 9.88 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.866 0.365 . . . . 0.0 111.524 176.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -89.65 10.73 22.08 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.654 0.74 . . . . 0.0 109.866 176.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.54 10.19 62.17 Favored Glycine 0 N--CA 1.453 -0.187 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.074 -177.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.426 ' HA2' ' HA ' ' A' ' 46' ' ' ALA . . . 96.57 -13.5 65.36 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.109 177.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASP . . . . . 0.515 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 47.6 m-20 -72.95 114.4 11.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.497 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 27.0 ptm -71.93 -21.81 61.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.899 -177.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 132.23 -159.62 23.4 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.86 -179.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.439 ' CH2' ' HG3' ' A' ' 94' ' ' GLN . 86.1 m95 -109.04 117.02 33.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.82 0.343 . . . . 0.0 110.633 -179.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.64 HD23 ' HD2' ' A' ' 8' ' ' TYR . 2.0 pp -103.66 151.81 22.53 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.79 174.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -92.39 136.77 32.92 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.103 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -57.04 147.99 22.8 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.144 177.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.73 6.99 6.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.263 -0.881 . . . . 0.0 112.383 -178.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 p -111.81 7.45 20.18 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 163.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.622 ' HB ' ' HE3' ' A' ' 65' ' ' LYS . 36.1 mt -86.24 127.25 62.17 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.633 -174.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -65.91 151.74 83.31 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.445 2.096 . . . . 0.0 111.396 174.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -59.34 -17.88 33.42 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.349 -176.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -64.04 -47.28 80.81 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.778 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.8 mp -83.4 -15.06 51.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.825 0.345 . . . . 0.0 110.659 177.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.622 ' HE3' ' HB ' ' A' ' 60' ' ' ILE . 33.2 mmtp -63.34 -30.51 71.63 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.487 0.66 . . . . 0.0 109.764 173.37 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -74.0 -11.52 60.36 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.263 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.618 ' HB3' HG12 ' A' ' 88' ' ' VAL . . . -70.49 -31.35 68.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.1 0.476 . . . . 0.0 111.151 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.47 19.3 64.43 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.751 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.701 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 18.6 mt -85.34 90.9 8.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.048 0.451 . . . . 0.0 111.142 -176.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -100.41 -43.49 6.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.66 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -107.64 135.31 49.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.764 0.316 . . . . 0.0 110.905 -174.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.603 ' HZ1' ' HB3' ' A' ' 72' ' ' LYS . 6.7 ttpm? -66.58 138.97 57.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.767 -171.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.39 -5.19 35.42 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -94.19 128.49 40.66 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.231 0.538 . . . . 0.0 110.035 177.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.741 HD12 HD12 ' A' ' 26' ' ' LEU . 1.2 pp -145.14 170.91 15.31 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.902 -175.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.625 ' HB2' ' CD1' ' A' ' 26' ' ' LEU . 25.6 t 79.25 49.71 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.425 1.078 . . . . 0.0 110.809 -174.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.417 ' O ' HG11 ' A' ' 88' ' ' VAL . . . -98.72 110.73 4.07 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 168.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.29 113.36 39.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -176.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.543 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 47.5 mm -97.0 114.84 34.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.478 -175.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.762 ' HG2' ' CE2' ' A' ' 85' ' ' PHE . 2.4 tmtp? -83.62 113.92 21.18 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.166 -174.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.7 m -122.93 167.41 13.61 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.134 176.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.5 t -84.59 -26.32 28.02 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 32.9 m -77.78 -10.45 13.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.241 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 149.24 -159.38 28.03 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.416 -0.674 . . . . 0.0 111.416 -179.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' PHE . . . . . 0.762 ' CE2' ' HG2' ' A' ' 80' ' ' LYS . 91.1 m-85 -125.66 132.5 52.42 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.848 0.356 . . . . 0.0 110.513 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.852 HD13 ' HB ' ' A' ' 10' ' ' ILE . 41.6 tp -107.19 135.37 48.84 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.147 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.667 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 22.4 mm -108.1 124.14 64.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.618 HG12 ' HB3' ' A' ' 67' ' ' ALA . 12.1 p -113.51 139.5 38.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.355 0.597 . . . . 0.0 111.232 -175.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . 0.659 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 7.5 ttp180 -136.49 148.0 47.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.815 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.701 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.9 mt -94.72 109.42 21.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.619 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.616 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 37.1 t70 -80.46 -55.05 5.15 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 119.942 -0.703 . . . . 0.0 111.58 175.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.581 ' HA ' ' HD3' ' A' ' 72' ' ' LYS . 35.9 t70 -157.13 160.21 38.59 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.62 0.248 . . . . 0.0 111.232 177.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.726 HG13 HG23 ' A' ' 6' ' ' THR . 3.8 mp -124.73 127.1 72.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 172.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.439 ' HG3' ' CH2' ' A' ' 54' ' ' TRP . 20.9 mt-30 -115.94 156.36 26.36 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -176.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . 72.83 -53.29 0.7 Allowed 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.025 -0.988 . . . . 0.0 112.551 176.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.645 ' HB2' ' HB2' ' A' ' 4' ' ' GLN . . . -57.34 -49.28 76.65 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.158 -174.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 33.5 t-80 -80.51 -20.27 43.96 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.009 -172.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -93.7 -27.21 16.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.527 -175.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -65.94 -69.5 0.3 Allowed 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 121.025 -0.27 . . . . 0.0 111.662 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -135.84 39.24 2.79 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.986 -0.285 . . . . 0.0 111.447 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 47.7 m170 54.4 75.85 0.27 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.475 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 11.2 m-70 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.301 -0.857 . . . . 0.0 109.713 170.947 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo . . . . . 0 N--CA 1.46 -0.471 0 CA-C-O 121.429 0.512 . . . . 0.0 113.429 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.492 ' HG3' ' HB2' ' A' ' 57' ' ' ASP . 13.1 pt20 -70.74 160.15 33.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.323 172.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.483 ' HB2' ' CG ' ' A' ' 94' ' ' GLN . 99.3 mtt180 -122.59 151.18 41.68 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.995 0.426 . . . . 0.0 111.024 -177.109 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.659 HG23 HD13 ' A' ' 93' ' ' ILE . 32.2 m -135.19 136.04 41.49 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.516 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.632 ' HD3' ' OD1' ' A' ' 91' ' ' ASP . 63.3 ttt180 -100.84 111.39 23.6 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.793 ' HD2' HD21 ' A' ' 55' ' ' LEU . 19.5 m-85 -106.84 141.06 38.67 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.742 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.498 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 14.7 m -112.84 131.95 55.49 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 169.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.615 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.7 pp -142.59 141.58 27.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 N-CA-C 110.369 -0.234 . . . . 0.0 110.369 -173.594 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.706 HD11 HG11 ' A' ' 22' ' ' VAL . 10.5 pt -140.42 144.87 26.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -103.37 128.97 50.33 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.924 0.392 . . . . 0.0 110.743 -176.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.725 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 10.9 p -109.0 156.21 20.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.186 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.502 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 71.9 mmtt -65.62 -49.1 69.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.379 -179.168 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.99 175.61 9.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.557 -177.284 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.684 ' HG2' ' HD3' ' A' ' 20' ' ' LYS . 26.7 tt0 -63.4 -31.32 72.44 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 176.916 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -56.62 -45.66 81.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.363 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.725 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 8.4 mm-40 -65.5 -43.01 91.49 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.97 179.088 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.82 -47.43 85.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.915 178.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.684 ' HD3' ' HG2' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -56.63 -40.85 76.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 175.639 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.92 -37.55 87.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.125 0.488 . . . . 0.0 110.689 177.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.706 HG11 HD11 ' A' ' 11' ' ' ILE . 73.5 t -71.59 -48.23 53.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.371 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.715 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -70.74 -27.85 64.27 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.324 -176.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -61.79 -43.61 98.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.079 0.466 . . . . 0.0 110.16 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.447 ' HG2' HD21 ' A' ' 35' ' ' LEU . 7.5 tp10 -69.66 -46.2 66.68 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.642 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.842 HD13 HD13 ' A' ' 75' ' ' LEU . 3.5 pp -73.0 -13.91 61.32 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.457 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.422 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -66.65 -28.2 68.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.188 0.518 . . . . 0.0 110.125 175.517 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -74.92 -32.19 61.73 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 170.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.14 36.11 13.64 Favored Glycine 0 N--CA 1.444 -0.776 0 CA-C-N 114.555 -1.202 . . . . 0.0 113.24 171.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.79 -64.16 1.26 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 118.877 -1.63 . . . . 0.0 112.741 -178.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -140.31 122.6 15.91 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.904 174.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.619 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 59.3 t80 -84.5 -38.13 20.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.008 0.432 . . . . 0.0 110.232 171.305 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.58 -38.41 66.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.838 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.49 ' O ' ' HG3' ' A' ' 38' ' ' GLU . . . -64.75 -42.85 94.84 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.504 0.669 . . . . 0.0 110.418 -178.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.447 HD21 ' HG2' ' A' ' 25' ' ' GLU . 9.8 mt -64.07 -36.44 84.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.448 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.595 ' HA ' HG21 ' A' ' 11' ' ' ILE . . . -63.29 -43.85 96.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.309 -1.314 . . . . 0.0 112.174 -176.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.404 ' HG3' ' HA ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -77.5 -30.17 52.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.945 -173.772 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 43.6 mt-10 -79.39 -57.81 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -170.365 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.589 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -99.32 -26.44 14.16 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.655 0.74 . . . . 0.0 112.276 -171.266 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.578 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 37.1 t -67.65 137.56 55.68 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -170.17 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.25 1.03 38.61 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.662 171.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.461 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 24.9 t70 -69.85 -14.87 62.96 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.952 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 1.05 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.3 pp -54.6 -14.72 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -155.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.889 ' H ' HD12 ' A' ' 44' ' ' ILE . 3.6 mp -51.18 -37.9 18.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 167.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.8 m -109.92 -32.93 6.87 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.816 174.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 1.05 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -54.58 -29.26 50.95 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.474 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.547 ' HG3' ' O ' ' A' ' 43' ' ' ILE . 80.4 mtp180 -59.34 -15.1 14.24 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 117.718 0.236 . . . . 0.0 111.44 178.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -83.69 9.64 11.2 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.974 0.416 . . . . 0.0 110.536 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.1 26.17 22.35 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 111.605 -0.598 . . . . 0.0 111.605 -176.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 83.64 -8.06 66.97 Favored Glycine 0 C--N 1.329 0.181 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -73.26 116.22 13.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.889 0.376 . . . . 0.0 111.184 -177.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.584 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 26.0 ptm -82.24 -19.38 39.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.697 176.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 118.24 177.0 17.0 Favored Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.957 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.568 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 72.2 m95 -84.37 114.68 22.05 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.682 0.277 . . . . 0.0 110.781 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.793 HD21 ' HD2' ' A' ' 8' ' ' TYR . 3.1 pp -98.01 155.72 16.97 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.594 175.03 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.43 ' HG2' ' HG2' ' A' ' 5' ' ' ARG . 35.5 mt-10 -96.63 145.33 25.85 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.492 ' HB2' ' HG3' ' A' ' 4' ' ' GLN . 13.8 t70 -65.13 141.2 58.78 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -176.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 72.14 9.22 5.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.335 -177.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 15.8 p -110.45 -0.1 17.6 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 167.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.715 HG12 HD13 ' A' ' 55' ' ' LEU . 25.0 mt -71.55 129.87 88.09 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.945 -176.282 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.446 ' HG2' HD13 ' A' ' 64' ' ' LEU . 30.1 Cg_endo -65.03 148.89 89.82 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.487 2.125 . . . . 0.0 111.169 173.042 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.678 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 0.8 OUTLIER -56.43 -25.24 49.75 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.462 -175.121 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.21 -49.74 75.05 Favored 'General case' 0 C--N 1.319 -0.743 0 O-C-N 123.41 0.444 . . . . 0.0 110.51 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.446 HD13 ' HG2' ' A' ' 61' ' ' PRO . 6.0 mp -83.42 -15.29 50.27 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.678 ' HD2' ' HA ' ' A' ' 62' ' ' ASP . 97.3 mttt -61.48 -31.97 71.97 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.449 0.642 . . . . 0.0 109.879 174.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -83.53 -5.37 59.15 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.6 -178.115 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.759 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -69.08 -32.01 71.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.007 0.432 . . . . 0.0 111.598 -178.606 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 70.19 17.7 74.23 Favored Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.477 174.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.709 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 15.3 mt -91.68 84.49 5.46 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -176.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.459 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 40.4 mmtm -102.73 -22.77 13.88 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 174.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -94.07 120.24 34.05 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.475 0.178 . . . . 0.0 111.157 -178.128 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.6 tttp -66.42 130.15 42.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.039 0.447 . . . . 0.0 111.452 -171.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.27 -12.49 40.19 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 111.224 -0.751 . . . . 0.0 111.224 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -78.23 122.29 25.5 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.106 0.479 . . . . 0.0 110.227 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.842 HD13 HD13 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -133.01 169.59 16.61 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.525 -179.673 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.697 ' HB2' HD11 ' A' ' 26' ' ' LEU . 23.1 t 77.99 53.24 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 124.178 0.924 . . . . 0.0 110.297 -174.726 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -101.11 108.77 3.5 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 110.227 -1.149 . . . . 0.0 110.227 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.2 t -99.17 113.72 34.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.144 0.497 . . . . 0.0 109.972 -176.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.472 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 69.2 mt -98.93 115.29 39.09 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.071 -178.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.576 ' HG2' ' HE2' ' A' ' 85' ' ' PHE . 1.5 tmtp? -81.19 113.66 19.49 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.905 -175.643 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.0 t -125.78 160.84 28.76 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 12.2 t -74.4 -26.28 59.99 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.156 0.503 . . . . 0.0 109.893 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 25.8 m -79.65 -10.12 12.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.988 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.16 -163.99 27.32 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 111.099 -0.8 . . . . 0.0 111.099 -178.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.576 ' HE2' ' HG2' ' A' ' 80' ' ' LYS . 96.7 m-85 -116.39 129.53 56.29 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.061 0.458 . . . . 0.0 110.892 -176.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.602 HD11 ' HB ' ' A' ' 10' ' ' ILE . 48.4 tp -103.93 135.06 46.16 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.875 -178.603 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.615 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 22.4 mm -107.64 121.4 60.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.144 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.759 HG11 ' HB1' ' A' ' 67' ' ' ALA . 14.8 p -110.5 137.48 42.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 CA-C-O 121.206 0.527 . . . . 0.0 111.024 -176.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.778 ' HG3' ' HB3' ' A' ' 75' ' ' LEU . 7.0 ttp180 -132.14 144.61 50.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.975 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.709 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 10.6 mt -93.22 110.47 21.98 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.359 177.136 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.632 ' OD1' ' HD3' ' A' ' 7' ' ' ARG . 17.5 t70 -79.06 -54.33 6.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.812 177.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.568 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 6.5 t70 -156.17 165.91 35.0 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.713 0.292 . . . . 0.0 111.529 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.659 HD13 HG23 ' A' ' 6' ' ' THR . 32.9 mm -130.81 128.98 63.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.778 -0.647 . . . . 0.0 109.409 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.483 ' CG ' ' HB2' ' A' ' 5' ' ' ARG . 10.5 pt20 . . . . . 0 C--N 1.327 -0.4 0 CA-C-O 121.078 0.466 . . . . 0.0 110.375 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 N--CA 1.454 -0.829 0 CA-C-O 121.006 0.336 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.62 ' HG3' ' HB3' ' A' ' 57' ' ' ASP . 13.8 pt20 -70.35 158.83 35.24 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 175.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.505 ' HG2' ' HA ' ' A' ' 56' ' ' GLU . 99.4 mtt180 -128.28 148.28 50.64 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.305 0.574 . . . . 0.0 111.596 -170.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.647 HG23 HD13 ' A' ' 93' ' ' ILE . 69.8 m -123.16 136.13 54.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.518 -177.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.422 ' HB2' ' CE2' ' A' ' 54' ' ' TRP . 68.5 ttt180 -99.93 111.69 23.99 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.174 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.757 ' HD2' HD21 ' A' ' 55' ' ' LEU . 12.4 m-85 -104.61 138.33 41.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.366 0.603 . . . . 0.0 111.549 -178.431 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.732 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 19.4 m -111.56 133.41 53.85 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 170.047 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.665 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.33 145.68 23.35 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.04 -174.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.68 HG12 ' HB ' ' A' ' 87' ' ' ILE . 3.3 pt -139.75 148.18 23.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -99.65 112.63 24.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.914 0.387 . . . . 0.0 110.667 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 21.7 p -96.12 144.84 26.0 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.186 176.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -84.88 -21.36 29.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.997 -169.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.485 ' O ' ' HB2' ' A' ' 18' ' ' GLU . 4.1 m -147.65 164.57 33.11 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.264 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.571 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 26.9 tt0 -69.71 -27.28 64.86 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.17 -39.47 82.61 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.477 172.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.619 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 5.8 mm-40 -64.23 -41.09 97.16 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.935 -1.029 . . . . 0.0 110.165 175.51 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.57 ' O ' ' HG ' ' A' ' 23' ' ' LEU . . . -63.18 -47.29 83.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.669 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 16' ' ' GLU . 74.4 mmtt -55.01 -44.11 74.25 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.156 0.503 . . . . 0.0 110.789 178.132 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.99 -37.07 72.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.151 -179.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.612 HG22 ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -76.2 -38.38 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.745 -175.416 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 19' ' ' ALA . 4.2 pp -72.61 -28.42 62.77 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 121.104 -0.239 . . . . 0.0 111.279 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.524 ' N ' HD12 ' A' ' 23' ' ' LEU . 30.3 t70 -58.01 -41.12 82.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.674 0.274 . . . . 0.0 111.553 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.672 ' HB3' HD21 ' A' ' 35' ' ' LEU . 0.7 OUTLIER -71.37 -44.04 65.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.104 0.478 . . . . 0.0 109.855 -179.367 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.593 ' HB3' ' CD1' ' A' ' 35' ' ' LEU . 3.8 pp -73.16 -16.94 61.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.674 -178.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -72.89 -25.01 60.92 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.235 0.54 . . . . 0.0 109.667 172.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -84.96 -24.55 28.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.918 0.866 . . . . 0.0 108.784 170.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.03 39.91 36.45 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 114.104 -1.407 . . . . 0.0 112.486 175.293 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.47 -64.46 1.44 Allowed Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 118.526 -1.797 . . . . 0.0 112.512 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.479 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 45.3 t0 -141.8 114.98 8.79 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 117.142 0.471 . . . . 0.0 111.127 170.294 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.631 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 32.8 t80 -77.47 -31.98 54.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.107 0.48 . . . . 0.0 109.747 173.687 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.475 ' HB1' ' HA2' ' A' ' 49' ' ' GLY . . . -64.62 -31.64 72.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.712 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.65 -40.85 84.52 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.357 0.599 . . . . 0.0 109.944 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' A' ' 25' ' ' GLU . 14.0 mt -62.25 -44.89 95.51 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.458 178.157 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.533 ' O ' ' HB2' ' A' ' 40' ' ' SER . . . -56.99 -47.48 80.69 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.592 -1.185 . . . . 0.0 111.529 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.525 ' HG2' ' HA ' ' A' ' 47' ' ' ARG . 39.4 mtpt -79.89 -32.99 40.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.153 -172.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -80.36 -60.7 2.22 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -169.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.619 ' HD3' ' HB3' ' A' ' 18' ' ' GLU . 1.1 ttmm -103.11 -25.05 13.54 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.984 0.897 . . . . 0.0 112.813 -170.612 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.564 ' O ' HG23 ' A' ' 43' ' ' ILE . 7.5 m -75.31 143.34 42.98 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.519 -169.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -79.19 1.61 23.96 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.611 0.719 . . . . 0.0 110.24 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.568 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 27.8 t70 -65.82 -16.65 64.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.395 176.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 1.014 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 3.5 pt -56.21 -17.88 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 114.579 1.325 . . . . 0.0 114.579 -157.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 71.0 mt -51.74 -39.8 25.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.268 0.556 . . . . 0.0 110.014 167.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 35.4 t -112.41 -28.96 7.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.345 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 1.014 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -51.71 -29.36 18.09 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -175.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.525 ' HA ' ' HG2' ' A' ' 37' ' ' LYS . 89.8 mtt180 -63.71 -8.84 11.44 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.354 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.8 p30 -90.38 10.32 25.49 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.958 0.409 . . . . 0.0 110.991 170.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.475 ' HA2' ' HB1' ' A' ' 33' ' ' ALA . . . 92.26 26.51 18.24 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 116.141 -0.482 . . . . 0.0 112.976 -176.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.42 20.06 79.79 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 121.62 -0.324 . . . . 0.0 113.364 173.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -97.0 122.94 40.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.014 0.435 . . . . 0.0 111.033 -176.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.548 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 27.0 ptm -82.68 -19.67 37.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.834 176.357 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 113.69 -171.22 13.69 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.0 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.535 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 84.4 m95 -90.68 125.47 35.67 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.004 0.43 . . . . 0.0 111.143 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.757 HD21 ' HD2' ' A' ' 8' ' ' TYR . 2.7 pp -115.33 156.51 25.36 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 173.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.516 ' O ' ' HB ' ' A' ' 59' ' ' THR . 25.3 mt-10 -81.67 132.26 35.29 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.964 0.412 . . . . 0.0 110.092 -177.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.62 ' HB3' ' HG3' ' A' ' 4' ' ' GLN . 31.9 t70 -73.22 145.32 46.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.277 -175.22 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 62.9 7.56 2.69 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.422 -172.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 56' ' ' GLU . 13.6 m -112.11 3.01 17.03 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.337 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.701 HG12 HD13 ' A' ' 55' ' ' LEU . 21.8 mt -73.59 133.59 79.88 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 113.835 -1.53 . . . . 0.0 110.865 -173.659 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.75 155.61 53.11 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.801 2.334 . . . . 0.0 111.839 174.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.664 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 8.9 m-20 -55.54 -27.51 49.31 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.048 -0.978 . . . . 0.0 112.708 -171.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.97 -55.49 32.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.936 178.266 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.514 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 5.2 mp -83.45 -16.59 45.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.532 -177.362 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.664 ' HD2' ' HA ' ' A' ' 62' ' ' ASP . 67.6 mttm -56.86 -44.12 81.85 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.602 0.715 . . . . 0.0 109.602 172.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -75.67 -5.34 45.09 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.017 -176.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.838 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -71.33 -31.09 66.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.037 0.446 . . . . 0.0 111.049 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 77.48 19.08 76.92 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.935 175.662 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.717 HD12 HG22 ' A' ' 88' ' ' VAL . 11.8 mt -96.11 87.26 4.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.839 0.352 . . . . 0.0 111.309 -177.465 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -100.69 -41.44 6.91 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -177.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.513 ' O ' HD13 ' A' ' 90' ' ' LEU . 31.5 tt0 -100.32 135.33 41.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.853 0.358 . . . . 0.0 111.351 -174.142 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.477 ' HE3' ' O ' ' A' ' 91' ' ' ASP . 1.6 tmtp? -66.48 135.39 54.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.522 -170.338 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.58 -11.96 39.08 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.495 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.513 ' HB3' HD12 ' A' ' 90' ' ' LEU . 64.3 tt0 -83.9 127.8 34.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.159 0.504 . . . . 0.0 110.705 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.586 HD13 HD12 ' A' ' 26' ' ' LEU . 1.4 pp -138.27 170.3 16.27 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.345 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.9 t 78.64 60.37 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 124.106 0.879 . . . . 0.0 111.093 -178.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -110.88 120.31 5.49 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 170.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 25.8 t -107.91 113.51 43.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.216 0.531 . . . . 0.0 110.346 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.489 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 43.9 mm -103.84 118.12 50.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.249 -178.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 85' ' ' PHE . 86.4 tttt -82.87 130.32 35.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.402 0.62 . . . . 0.0 111.164 -178.081 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.3 m -126.96 166.92 16.62 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.041 173.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.3 m -79.04 -26.02 43.16 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.496 0.665 . . . . 0.0 109.337 177.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 33.6 m -85.47 -5.84 10.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.531 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.25 -157.24 27.12 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.884 -0.675 . . . . 0.0 111.851 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.535 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 83.1 m-85 -124.85 136.55 53.91 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 117.035 0.417 . . . . 0.0 110.333 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.665 HD11 ' HB ' ' A' ' 10' ' ' ILE . 57.1 tp -107.78 135.49 49.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.775 0.321 . . . . 0.0 110.382 -178.533 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.68 ' HB ' HG12 ' A' ' 11' ' ' ILE . 24.9 mm -108.95 127.55 65.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.461 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.838 HG11 ' HB1' ' A' ' 67' ' ' ALA . 11.1 p -112.78 141.01 29.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.268 0.556 . . . . 0.0 110.542 -176.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.732 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 1.5 tmm_? -142.16 130.92 22.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.879 -174.227 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.676 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.8 mt -87.4 109.68 19.74 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 120.702 0.287 . . . . 0.0 111.31 178.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.477 ' O ' ' HE3' ' A' ' 72' ' ' LYS . 11.9 t70 -79.42 -53.92 6.43 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.662 177.763 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.535 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 28.7 t0 -156.0 164.52 38.35 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.932 -0.307 . . . . 0.0 111.781 -178.387 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.647 HD13 HG23 ' A' ' 6' ' ' THR . 26.6 mm -134.65 123.84 42.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.125 176.448 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.513 ' HG2' ' CZ3' ' A' ' 54' ' ' TRP . 28.9 pt20 . . . . . 0 C--N 1.327 -0.387 0 CA-C-O 121.025 0.441 . . . . 0.0 110.603 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo . . . . . 0 N--CA 1.459 -0.523 0 CA-C-O 121.211 0.421 . . . . 0.0 112.891 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -75.59 158.65 32.18 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.132 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.491 ' HE ' ' HG2' ' A' ' 56' ' ' GLU . 99.7 mtt180 -121.85 145.73 47.79 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.437 0.637 . . . . 0.0 112.11 -171.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 26.1 m -135.09 141.22 46.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.384 -176.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.586 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 57.3 ttt180 -100.4 111.91 24.22 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 177.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.5 ' HE1' ' HB3' ' A' ' 69' ' ' LEU . 23.1 m-85 -106.67 139.67 40.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.154 0.502 . . . . 0.0 111.569 -178.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 50' ' ' GLY . 9.8 m -117.49 132.38 56.56 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 171.616 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.69 ' HB ' HD21 ' A' ' 86' ' ' LEU . 2.7 pp -140.69 145.31 25.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -174.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.637 HG21 ' HA ' ' A' ' 36' ' ' ALA . 7.3 pt -140.46 138.56 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -98.13 118.32 34.48 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.986 0.422 . . . . 0.0 110.163 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.736 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 52.7 p -94.34 149.65 21.03 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.246 174.089 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.54 ' HB2' ' OE2' ' A' ' 18' ' ' GLU . 25.2 mttp -77.75 -25.47 49.21 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.497 -173.21 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -141.97 168.25 20.2 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.357 176.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.432 ' HB2' ' CZ ' ' A' ' 85' ' ' PHE . 23.9 tt0 -64.68 -32.95 74.84 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -53.71 -41.68 67.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.632 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.736 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 49.9 mt-10 -69.68 -41.31 75.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.384 178.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.545 ' HA ' HD11 ' A' ' 87' ' ' ILE . . . -59.41 -39.1 82.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.405 178.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -55.32 -50.91 68.39 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.812 0.339 . . . . 0.0 110.775 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.21 -30.87 70.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.08 -177.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.815 HG22 ' HE3' ' A' ' 39' ' ' LYS . 21.9 t -75.51 -52.2 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.899 -0.592 . . . . 0.0 109.806 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.438 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -66.48 -28.45 68.59 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.051 -176.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.419 ' N ' HD12 ' A' ' 23' ' ' LEU . 17.8 t70 -64.24 -44.2 92.56 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.025 0.441 . . . . 0.0 110.369 175.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.421 ' HG2' HD21 ' A' ' 35' ' ' LEU . 4.2 tp10 -75.53 -45.45 38.01 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.98 -175.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.863 HD13 HD13 ' A' ' 75' ' ' LEU . 3.1 pp -72.55 -14.93 61.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.746 0.308 . . . . 0.0 110.984 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.481 ' N ' HD12 ' A' ' 26' ' ' LEU . 1.0 OUTLIER -63.01 -27.69 69.59 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 174.009 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.03 -25.62 17.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.767 0.794 . . . . 0.0 109.373 173.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.45 45.63 13.75 Favored Glycine 0 N--CA 1.448 -0.514 0 CA-C-N 114.597 -1.183 . . . . 0.0 113.879 168.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.28 -64.26 1.66 Allowed Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 118.706 -1.711 . . . . 0.0 112.593 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.515 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 45.3 t0 -141.1 115.91 9.71 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 117.109 0.454 . . . . 0.0 111.474 171.458 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.412 ' HA ' HD12 ' A' ' 35' ' ' LEU . 60.8 t80 -77.19 -33.14 56.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.817 0.342 . . . . 0.0 110.374 174.466 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.3 -30.34 71.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.815 -177.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.6 -42.21 71.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.425 0.631 . . . . 0.0 109.552 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 31' ' ' ASP . 13.0 mt -61.28 -45.05 96.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.1 -0.954 . . . . 0.0 109.258 176.089 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.637 ' HA ' HG21 ' A' ' 11' ' ' ILE . . . -56.19 -51.05 69.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.31 -1.314 . . . . 0.0 112.244 -176.59 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.669 ' HG2' ' HA ' ' A' ' 47' ' ' ARG . 54.0 mtpt -78.21 -22.65 48.2 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.782 -170.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -80.09 -59.8 2.58 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.815 ' HE3' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -103.33 -22.88 13.63 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -171.834 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.417 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 0.7 OUTLIER -75.18 147.67 40.23 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.413 -163.704 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.15 4.12 24.49 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.826 0.822 . . . . 0.0 109.651 174.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.797 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 14.6 t70 -68.92 -15.05 63.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.383 -1.281 . . . . 0.0 112.146 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.973 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.4 pp -54.81 -14.97 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -153.471 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.859 ' H ' HD12 ' A' ' 44' ' ' ILE . 4.1 mp -51.62 -40.48 25.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 166.641 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.7 p -120.04 -6.16 9.99 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.675 177.299 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.973 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -71.39 -29.88 65.45 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.923 -0.486 . . . . 0.0 111.091 179.4 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.669 ' HA ' ' HG2' ' A' ' 37' ' ' LYS . 79.7 mtp180 -59.09 -28.58 66.63 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.668 -177.356 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.407 HD22 ' HB3' ' A' ' 51' ' ' ASP . 2.8 p-10 -90.09 13.24 15.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.131 0.491 . . . . 0.0 110.903 176.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.59 21.87 30.43 Favored Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.959 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.413 ' O ' ' HA ' ' A' ' 9' ' ' SER . . . 72.37 11.34 76.02 Favored Glycine 0 C--N 1.327 0.062 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.185 175.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.407 ' HB3' HD22 ' A' ' 48' ' ' ASN . 4.4 t70 -76.3 115.76 16.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.341 -0.429 . . . . 0.0 110.781 -178.412 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.528 ' SD ' HG12 ' A' ' 10' ' ' ILE . 88.1 mtp -79.6 -20.94 45.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.319 0.58 . . . . 0.0 109.606 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 107.83 -162.17 13.3 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.046 -177.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -95.55 119.26 33.74 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.904 0.383 . . . . 0.0 110.811 178.308 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.482 HD13 ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -108.7 155.85 20.25 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.193 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.491 ' HG2' ' HE ' ' A' ' 5' ' ' ARG . 40.2 mt-10 -93.99 131.07 39.82 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.532 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -61.53 148.94 40.45 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.402 -174.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 63.87 6.77 2.9 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.711 -174.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 5.1 m -112.18 -0.74 15.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 122.24 1.019 . . . . 0.0 108.764 168.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.651 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 24.3 mt -75.2 137.61 72.07 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.524 -175.647 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.52 ' HG2' HD13 ' A' ' 64' ' ' LEU . 18.8 Cg_endo -61.37 146.12 97.54 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.345 2.03 . . . . 0.0 111.244 174.545 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.646 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 7.8 p-10 -56.59 -24.0 44.53 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.251 -172.308 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -57.64 -49.03 77.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.356 0.41 . . . . 0.0 110.802 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.52 HD13 ' HG2' ' A' ' 61' ' ' PRO . 6.4 mp -83.1 -15.34 51.23 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.317 -178.185 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.651 ' HE3' ' O ' ' A' ' 60' ' ' ILE . 94.2 mttt -64.08 -34.32 77.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.584 0.707 . . . . 0.0 110.089 174.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -71.8 -5.72 36.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.527 -178.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.618 ' HB1' HD13 ' A' ' 69' ' ' LEU . . . -70.85 -39.16 73.12 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.088 0.47 . . . . 0.0 111.227 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 72.13 15.4 76.62 Favored Glycine 0 C--N 1.332 0.345 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.132 -174.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.622 ' C ' HD11 ' A' ' 90' ' ' LEU . 6.7 mp -81.33 78.69 8.09 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -174.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.406 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 70.7 mmtt -102.44 -16.62 16.12 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 175.506 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -109.08 125.52 52.22 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 122.214 -0.304 . . . . 0.0 111.278 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.799 ' HB2' HD13 ' A' ' 93' ' ' ILE . 87.5 tttt -66.11 133.4 50.65 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.22 0.533 . . . . 0.0 112.139 -169.725 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 101.58 -3.88 53.73 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.253 -177.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.646 ' HB3' HD12 ' A' ' 90' ' ' LEU . 64.6 tt0 -80.44 114.43 19.34 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 121.31 0.576 . . . . 0.0 109.722 175.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.863 HD13 HD13 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -133.64 169.78 16.52 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.911 178.8 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.618 ' HB2' HD11 ' A' ' 26' ' ' LEU . 18.5 t 78.56 46.2 0.05 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 122.007 0.908 . . . . 0.0 110.358 -174.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -96.96 103.74 2.95 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 167.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 17.7 t -103.09 113.13 38.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -174.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 59.9 mt -94.1 109.43 22.03 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.602 -177.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.428 ' HD2' ' HE2' ' A' ' 85' ' ' PHE . 26.0 tttt -75.28 113.69 12.95 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.391 -174.386 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.561 ' HB2' ' O ' ' A' ' 84' ' ' GLY . 14.9 m -126.75 137.87 53.3 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.403 -1.271 . . . . 0.0 107.936 173.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.8 p -62.47 -26.02 68.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.352 -175.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 19.9 m -79.59 -19.4 12.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.297 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLY . . . . . 0.561 ' O ' ' HB2' ' A' ' 81' ' ' SER . . . 161.08 163.59 14.38 Favored Glycine 0 N--CA 1.444 -0.787 0 N-CA-C 111.006 -0.837 . . . . 0.0 111.006 -175.045 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.432 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 57.8 m-85 -109.6 127.96 54.88 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 120.77 0.319 . . . . 0.0 110.798 -172.728 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.69 HD21 ' HB ' ' A' ' 10' ' ' ILE . 1.2 tt -111.16 138.49 47.54 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 121.545 0.688 . . . . 0.0 110.666 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.591 ' N ' HD23 ' A' ' 86' ' ' LEU . 6.5 mt -117.46 121.37 67.42 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 CA-C-N 114.557 -1.202 . . . . 0.0 110.588 -175.052 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.54 HG22 HD22 ' A' ' 69' ' ' LEU . 7.1 p -113.06 141.38 28.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.667 -176.493 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.724 ' HB2' ' HB3' ' A' ' 75' ' ' LEU . 2.8 ptm180 -138.45 158.31 44.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.449 0.642 . . . . 0.0 110.72 174.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.871 HD22 HD11 ' A' ' 93' ' ' ILE . 12.9 mt -96.57 109.6 22.17 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.207 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.586 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 21.7 t70 -79.56 -53.91 6.41 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.052 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.486 ' C ' HD12 ' A' ' 93' ' ' ILE . 43.2 t0 -155.03 160.57 41.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.741 -177.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.871 HD11 HD22 ' A' ' 90' ' ' LEU . 1.7 mp -128.87 136.05 60.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.092 -0.503 . . . . 0.0 109.879 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 . . . . . 0 C--N 1.331 -0.217 0 CA-C-O 120.871 0.367 . . . . 0.0 111.322 178.645 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo . . . . . 0 N--CA 1.446 -1.305 0 CA-C-O 121.054 0.356 . . . . 0.0 111.482 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.615 ' HG3' ' HB3' ' A' ' 57' ' ' ASP . 12.7 pt20 -80.74 158.8 25.39 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.663 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 49.6 mtt180 -128.99 151.21 49.93 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.08 0.467 . . . . 0.0 111.51 -171.696 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.9 m -128.62 131.12 48.08 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.717 176.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.539 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 58.8 ttt180 -95.61 111.74 23.61 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.68 -0.408 . . . . 0.0 109.9 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.681 ' HD2' HD21 ' A' ' 55' ' ' LEU . 22.4 m-85 -106.43 146.47 30.47 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.481 0.658 . . . . 0.0 111.131 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.471 ' HB2' ' HE ' ' A' ' 89' ' ' ARG . 16.2 m -125.86 132.52 52.17 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 169.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.676 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.9 pp -136.67 149.14 26.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 -175.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.678 HD11 HG11 ' A' ' 22' ' ' VAL . 5.3 pt -140.32 147.59 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 177.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -103.99 121.32 42.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.386 -176.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.779 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 73.8 p -97.86 153.76 18.1 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.61 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -84.9 -25.57 27.85 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.219 -175.159 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.0 m -149.9 165.24 33.19 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 176.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.688 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 30.6 tt0 -56.12 -39.34 72.07 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.047 0.451 . . . . 0.0 110.384 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -57.53 -38.6 74.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.918 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.976 ' HB3' ' HD2' ' A' ' 39' ' ' LYS . 10.9 mm-40 -64.89 -36.28 83.85 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.82 -176.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.629 ' HA ' HD11 ' A' ' 87' ' ' ILE . . . -70.69 -38.61 73.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.595 178.361 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.688 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.0 mmtp -58.51 -43.66 89.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.308 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.06 -34.27 77.64 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.817 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.678 HG11 HD11 ' A' ' 11' ' ' ILE . 92.1 t -73.52 -49.25 37.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.331 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.669 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.5 pp -65.72 -28.54 69.13 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.215 -176.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.453 ' N ' HD12 ' A' ' 23' ' ' LEU . 19.2 t70 -63.8 -46.47 85.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.097 0.475 . . . . 0.0 110.412 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -75.07 -38.85 61.18 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.854 -175.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.115 HD11 ' HB3' ' A' ' 76' ' ' SER . 2.7 pp -72.71 -17.09 61.66 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.153 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.509 ' N ' HD12 ' A' ' 26' ' ' LEU . 2.0 m-80 -69.35 -21.16 63.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.121 0.486 . . . . 0.0 110.139 175.111 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -77.63 -26.2 50.36 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 172.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.13 31.32 52.96 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-N 114.486 -1.234 . . . . 0.0 112.627 173.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -91.2 -64.11 1.18 Allowed Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 118.758 -1.687 . . . . 0.0 113.301 -177.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.452 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 8.0 t0 -140.1 115.47 9.94 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 122.76 -0.259 . . . . 0.0 111.351 177.53 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.481 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 93.1 t80 -85.4 -41.31 15.55 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.96 0.41 . . . . 0.0 110.893 172.356 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.74 -33.81 61.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.259 -178.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.32 -44.52 75.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.311 178.298 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 31' ' ' ASP . 12.4 mt -60.57 -38.36 84.33 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.636 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.54 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -59.53 -50.93 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.502 179.166 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -69.61 -35.33 75.17 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.921 -173.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.49 -55.48 5.18 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -175.54 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.976 ' HD2' ' HB3' ' A' ' 18' ' ' GLU . 1.0 OUTLIER -96.73 -24.04 16.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.701 0.762 . . . . 0.0 112.869 -166.373 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.629 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 29.0 t -93.44 147.38 23.01 Favored 'General case' 0 C--N 1.291 -1.94 0 O-C-N 121.514 -0.741 . . . . 0.0 112.93 -167.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.53 0.62 41.76 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.11 174.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.663 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 31.4 t70 -59.87 -14.69 16.44 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.46 -1.246 . . . . 0.0 112.666 178.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 1.046 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.5 pp -54.73 -14.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -152.326 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.431 ' N ' HD12 ' A' ' 43' ' ' ILE . 44.3 mm -51.82 -33.04 15.19 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 CA-C-O 121.378 0.608 . . . . 0.0 109.539 165.79 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.8 m -119.62 -20.39 7.73 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.212 174.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 1.046 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -64.32 -29.98 71.04 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 121.84 -0.537 . . . . 0.0 111.767 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -57.15 -34.28 68.25 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.603 0.239 . . . . 0.0 111.521 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -88.71 13.87 11.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.233 0.54 . . . . 0.0 110.934 176.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.78 24.66 22.6 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.342 -0.844 . . . . 0.0 113.049 178.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.02 14.2 76.1 Favored Glycine 0 CA--C 1.51 -0.254 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.129 174.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -85.58 115.8 23.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.897 0.379 . . . . 0.0 110.311 -176.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.426 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 26.1 ptm -80.64 -19.62 44.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.118 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 115.02 -166.61 12.18 Favored Glycine 0 N--CA 1.439 -1.128 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.737 -178.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.792 ' CZ3' ' HB2' ' A' ' 94' ' ' GLN . 82.4 m95 -98.85 113.37 25.46 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.914 0.387 . . . . 0.0 111.081 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.725 HD13 HG12 ' A' ' 60' ' ' ILE . 2.6 pp -99.64 153.31 19.17 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.372 173.457 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -84.92 132.72 34.34 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.615 ' HB3' ' HG3' ' A' ' 4' ' ' GLN . 23.8 t70 -67.56 145.39 54.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.292 -175.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 65.4 7.13 4.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.903 -173.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.8 m -112.72 9.32 19.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 122.032 0.92 . . . . 0.0 108.828 166.095 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.725 HG12 HD13 ' A' ' 55' ' ' LEU . 6.0 mt -81.94 137.79 46.64 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.705 -172.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 60' ' ' ILE . 31.9 Cg_exo -61.27 152.36 72.77 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.742 2.295 . . . . 0.0 111.582 176.356 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.03 -25.26 66.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.77 -168.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.552 ' HA ' ' ND2' ' A' ' 66' ' ' ASN . 41.1 tt0 -70.01 -25.88 63.8 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.377 0.608 . . . . 0.0 110.257 177.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.598 ' HB2' HG22 ' A' ' 60' ' ' ILE . 4.4 mm? -80.93 -22.85 39.33 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.116 176.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -72.97 -44.75 60.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.541 178.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASN . . . . . 0.552 ' ND2' ' HA ' ' A' ' 63' ' ' GLU . 5.0 p30 -74.46 -6.06 46.14 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.967 0.413 . . . . 0.0 110.435 -177.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.954 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -62.83 -32.22 73.38 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.402 173.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.22 26.82 54.28 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.889 175.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.684 HD12 HG22 ' A' ' 88' ' ' VAL . 10.3 mt -102.64 86.88 2.85 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.839 0.352 . . . . 0.0 111.714 -176.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -101.25 -41.9 6.53 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.671 176.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -94.18 127.87 40.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.92 0.391 . . . . 0.0 111.825 -175.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.836 ' HE2' ' HA ' ' A' ' 92' ' ' ASP . 51.0 tttm -66.71 133.77 50.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.267 -172.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.04 -8.41 38.79 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.25 -0.74 . . . . 0.0 111.25 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -86.93 128.09 35.06 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.143 0.497 . . . . 0.0 109.996 178.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.677 HD12 ' HB2' ' A' ' 26' ' ' LEU . 2.2 pt? -144.62 169.9 17.1 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.823 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' SER . . . . . 1.115 ' HB3' HD11 ' A' ' 26' ' ' LEU . 57.4 p 78.1 45.79 0.06 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.476 1.51 . . . . 0.0 111.266 -171.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -91.56 103.98 3.11 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 168.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 16.8 t -97.96 113.6 33.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.172 0.51 . . . . 0.0 109.855 -174.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.6 HD11 ' HA ' ' A' ' 67' ' ' ALA . 49.9 mm -103.99 124.07 58.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.439 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -82.56 126.23 32.04 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.132 0.491 . . . . 0.0 110.51 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.7 t -129.53 158.84 38.13 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 175.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.5 p -66.37 -25.84 66.98 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.958 0.409 . . . . 0.0 110.764 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 34.9 m -83.27 -11.36 11.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.423 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.95 -161.39 27.82 Favored Glycine 0 C--O 1.226 -0.366 0 N-CA-C 111.502 -0.639 . . . . 0.0 111.502 -177.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.599 ' HB2' ' OG1' ' A' ' 13' ' ' THR . 95.3 m-85 -111.14 138.68 47.27 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 117.334 0.567 . . . . 0.0 110.842 -178.225 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.676 HD11 ' HB ' ' A' ' 10' ' ' ILE . 36.2 tp -114.53 135.71 53.82 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.944 -177.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.629 HD11 ' HA ' ' A' ' 19' ' ' ALA . 15.7 mt -113.23 121.21 65.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.306 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.954 HG11 ' HB1' ' A' ' 67' ' ' ALA . 14.8 p -106.28 140.42 24.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.071 -175.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.481 ' HD3' ' CG ' ' A' ' 32' ' ' PHE . 15.3 ttp85 -132.23 141.79 49.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.792 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.665 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.0 mt -94.55 108.83 20.77 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.448 175.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.539 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 22.6 t70 -80.62 -54.98 5.17 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.098 -0.641 . . . . 0.0 111.815 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.836 ' HA ' ' HE2' ' A' ' 72' ' ' LYS . 9.1 t70 -156.63 170.13 23.1 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.165 -174.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.43 HG12 ' HB2' ' A' ' 72' ' ' LYS . 45.5 mm -127.59 120.05 53.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.792 ' HB2' ' CZ3' ' A' ' 54' ' ' TRP . 6.9 tt0 . . . . . 0 C--N 1.326 -0.435 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -169.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo . . . . . 0 N--CA 1.457 -0.647 0 CA-C-O 120.925 0.302 . . . . 0.0 112.11 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -70.31 158.46 35.88 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.632 ' HE ' ' HG2' ' A' ' 56' ' ' GLU . 99.1 mtt180 -122.31 135.39 54.72 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.47 0.652 . . . . 0.0 111.741 -173.186 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.632 HG23 HD13 ' A' ' 93' ' ' ILE . 32.0 m -120.46 137.42 54.35 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.205 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.553 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 62.8 ttt180 -96.25 110.88 23.1 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 177.374 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.694 ' HD2' HD21 ' A' ' 55' ' ' LEU . 19.2 m-85 -109.27 137.59 46.92 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.144 0.497 . . . . 0.0 111.328 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.701 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 15.3 m -109.8 132.31 54.27 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.464 -0.789 . . . . 0.0 108.913 169.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.739 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.9 pp -142.73 143.82 25.08 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -177.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.688 HD11 HG11 ' A' ' 22' ' ' VAL . 12.4 pt -140.18 146.57 24.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.24 175.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -97.41 118.74 34.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.102 0.477 . . . . 0.0 110.386 -177.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.518 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 41.3 p -98.06 154.56 17.64 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.516 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.674 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 72.7 mmtt -67.2 -37.63 83.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.024 -176.41 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.453 HG22 ' H ' ' A' ' 16' ' ' GLU . 2.7 m -152.37 171.32 18.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.835 -176.19 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.579 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 39.3 tt0 -61.7 -35.26 77.51 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-O 121.219 0.533 . . . . 0.0 109.677 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -56.32 -43.27 78.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.413 175.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.674 ' HG3' ' HB2' ' A' ' 14' ' ' LYS . 6.5 mm-40 -61.52 -41.21 96.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.33 177.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.585 ' HB1' HD11 ' A' ' 87' ' ' ILE . . . -60.78 -41.6 95.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.698 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.579 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.5 mmtp -55.63 -49.07 73.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.563 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -31.41 72.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.016 0.436 . . . . 0.0 111.022 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.688 HG11 HD11 ' A' ' 11' ' ' ILE . 62.8 t -73.78 -51.28 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.172 178.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.602 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 4.5 pp -65.45 -30.67 71.48 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.595 -174.227 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.535 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 15.3 t70 -57.18 -53.99 51.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.942 0.401 . . . . 0.0 110.798 -178.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -73.79 -33.69 64.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.638 -175.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.748 HD11 ' HB2' ' A' ' 76' ' ' SER . 3.6 pp -73.17 -21.25 60.73 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.345 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -70.53 -30.2 66.88 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.052 0.453 . . . . 0.0 109.978 172.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -69.43 -31.6 70.03 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 171.656 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.28 33.12 29.57 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.773 -1.103 . . . . 0.0 113.049 171.153 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.56 -64.3 1.21 Allowed Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 118.932 -1.604 . . . . 0.0 112.887 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -140.54 118.66 11.95 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.049 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.57 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 32.0 t80 -84.34 -31.21 24.93 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 175.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.456 ' CB ' ' HA2' ' A' ' 49' ' ' GLY . . . -60.68 -34.44 74.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.071 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.77 88.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.319 0.581 . . . . 0.0 110.084 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.701 ' CD1' ' HB3' ' A' ' 26' ' ' LEU . 6.6 mt -66.35 -42.87 87.44 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.94 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.51 ' CB ' HG21 ' A' ' 11' ' ' ILE . . . -64.06 -54.42 34.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.596 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.412 ' HA ' HG22 ' A' ' 43' ' ' ILE . 40.0 mtpt -70.16 -32.07 69.85 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.215 -169.368 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -81.18 -60.01 2.44 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 2.5 ttmm -102.16 -26.03 13.5 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 116.101 1.889 . . . . 0.0 116.101 -167.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.435 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 52.8 p -81.08 162.17 23.85 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 121.536 -0.728 . . . . 0.0 112.833 -170.679 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.7 3.43 29.12 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.194 174.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.521 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 36.1 t70 -71.46 -16.29 62.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.444 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.96 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.9 pp -56.18 -16.44 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -157.418 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.733 ' H ' HD12 ' A' ' 44' ' ' ILE . 4.1 mp -57.57 -41.09 78.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.117 0.484 . . . . 0.0 109.936 170.391 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.5 m -109.43 -14.35 14.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.294 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.96 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -53.04 -28.69 25.75 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.836 0.454 . . . . 0.0 112.142 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 87.8 mtt180 -53.45 -26.71 21.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.319 178.272 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASN . . . . . 0.487 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 85.9 m-20 -79.43 -0.38 32.73 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.86 0.362 . . . . 0.0 110.885 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.456 ' HA2' ' CB ' ' A' ' 33' ' ' ALA . . . 90.89 33.25 8.41 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 111.359 -0.697 . . . . 0.0 111.359 -173.182 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.535 ' O ' ' HA ' ' A' ' 9' ' ' SER . . . 71.33 11.01 70.95 Favored Glycine 0 C--N 1.334 0.434 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -175.198 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.487 ' HB3' ' HB3' ' A' ' 48' ' ' ASN . 9.4 t70 -76.74 119.28 20.3 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.124 -0.538 . . . . 0.0 111.924 -172.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 77.9 mmm -77.66 -21.4 52.19 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.495 172.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 102.8 -169.49 19.18 Favored Glycine 0 N--CA 1.437 -1.27 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.011 -176.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.479 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 93.8 m95 -88.13 112.75 23.04 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.181 0.515 . . . . 0.0 110.824 178.026 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.694 HD21 ' HD2' ' A' ' 8' ' ' TYR . 2.9 pp -105.14 154.7 19.83 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.686 177.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.632 ' HG2' ' HE ' ' A' ' 5' ' ' ARG . 22.8 mt-10 -88.39 127.99 35.51 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -64.12 151.35 43.44 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 73.02 8.9 5.41 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.02 0.825 . . . . 0.0 111.544 -175.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.2 p -111.49 -0.17 16.3 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 164.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.472 ' CG2' ' HB2' ' A' ' 64' ' ' LEU . 59.5 mt -78.18 129.91 73.91 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.6 -171.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 60' ' ' ILE . 20.8 Cg_exo -66.77 156.97 63.48 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 123.138 2.559 . . . . 0.0 111.916 175.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.67 -26.86 57.45 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.16 -0.927 . . . . 0.0 112.521 -173.084 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.465 ' HG3' HG21 ' A' ' 79' ' ' ILE . 0.4 OUTLIER -55.74 -52.37 64.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.369 . . . . 0.0 110.795 177.323 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.472 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 6.0 mp -83.09 -12.47 57.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.942 -178.501 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -67.33 -49.09 65.51 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 172.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -68.05 -13.36 62.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.346 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.846 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -64.67 -27.83 69.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.18 0.514 . . . . 0.0 110.84 177.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 65.38 27.04 72.03 Favored Glycine 0 C--N 1.334 0.462 0 CA-C-N 115.123 -0.944 . . . . 0.0 113.373 174.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.72 HD12 HG22 ' A' ' 88' ' ' VAL . 12.5 mt -97.15 71.22 2.41 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.8 0.333 . . . . 0.0 111.778 -175.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.444 ' HD3' ' HA ' ' A' ' 70' ' ' LYS . 44.2 mmtm -101.97 -25.74 13.66 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.779 0.323 . . . . 0.0 111.663 175.149 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -92.96 120.94 33.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.844 ' HD2' ' HA ' ' A' ' 92' ' ' ASP . 37.3 ttpt -67.1 144.69 55.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.263 0.554 . . . . 0.0 111.95 -170.037 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 99.91 -16.3 58.59 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.382 -177.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.435 ' HB3' HD12 ' A' ' 90' ' ' LEU . 63.0 tt0 -81.58 122.89 28.16 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.156 0.503 . . . . 0.0 110.407 -178.293 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.723 HD13 HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -142.27 169.63 17.23 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.775 -178.493 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.748 ' HB2' HD11 ' A' ' 26' ' ' LEU . 30.8 t 78.49 56.12 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 O-C-N 124.277 0.986 . . . . 0.0 110.775 -176.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -102.83 117.06 5.66 Favored Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 109.919 -1.272 . . . . 0.0 109.919 169.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 14.3 t -99.24 113.45 34.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.002 0.429 . . . . 0.0 109.957 -174.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.465 HG21 ' HG3' ' A' ' 63' ' ' GLU . 38.9 mm -110.64 120.27 61.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.258 -179.313 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -81.68 132.02 35.28 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.064 0.459 . . . . 0.0 111.059 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.0 m -114.93 167.09 11.09 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.49 -0.777 . . . . 0.0 108.917 172.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.5 t -72.46 -26.32 61.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.005 0.431 . . . . 0.0 109.866 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.6 m -97.64 -5.54 9.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.265 -177.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.77 -155.77 27.22 Favored Glycine 0 C--O 1.227 -0.342 0 C-N-CA 120.346 -0.93 . . . . 0.0 112.47 -178.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.492 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 82.1 m-85 -127.28 134.73 50.0 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.0 110.782 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.739 HD11 ' HB ' ' A' ' 10' ' ' ILE . 51.0 tp -110.53 135.47 51.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.438 -177.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.685 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 34.7 mm -107.45 126.77 63.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.961 178.045 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.846 HG11 ' HB1' ' A' ' 67' ' ' ALA . 11.7 p -108.12 140.61 25.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.056 0.455 . . . . 0.0 110.53 -178.238 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.716 ' HG2' ' HB3' ' A' ' 75' ' ' LEU . 2.5 tmm_? -142.31 133.21 25.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.654 -174.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.717 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 12.7 mt -89.09 109.7 20.51 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 176.637 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.553 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 20.2 t70 -80.44 -54.14 5.96 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.358 176.383 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.844 ' HA ' ' HD2' ' A' ' 72' ' ' LYS . 28.3 t70 -155.35 168.7 26.24 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.545 -179.429 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.632 HD13 HG23 ' A' ' 6' ' ' THR . 31.4 mm -129.97 131.09 66.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.13 -179.05 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 . . . . . 0 C--N 1.327 -0.402 0 CA-C-O 120.729 0.3 . . . . 0.0 110.629 178.77 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.453 -0.864 0 CA-C-O 121.016 0.34 . . . . 0.0 112.05 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.66 158.95 35.32 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.699 ' HG3' ' HB2' ' A' ' 94' ' ' GLN . 23.9 ptt180 -121.54 139.28 53.71 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.162 -0.615 . . . . 0.0 112.0 -176.135 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.59 HG23 HD13 ' A' ' 93' ' ' ILE . 85.6 m -126.1 141.13 52.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.863 -175.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.573 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 56.9 ttt180 -101.42 121.41 41.89 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.748 ' HD2' HD21 ' A' ' 55' ' ' LEU . 25.0 m-85 -115.52 130.66 56.95 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.122 0.487 . . . . 0.0 111.886 -178.414 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.535 ' HB2' ' HE ' ' A' ' 89' ' ' ARG . 16.5 m -112.31 136.31 51.91 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 173.532 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.664 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.31 146.11 22.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 110.262 -0.273 . . . . 0.0 110.262 -175.083 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.697 HG12 ' HB ' ' A' ' 87' ' ' ILE . 3.0 pt -140.39 143.03 30.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 176.248 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -99.71 128.33 45.81 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.724 0.297 . . . . 0.0 110.53 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.616 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 11.5 p -103.69 153.82 20.23 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 -178.56 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -76.94 -31.99 57.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.976 -177.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.405 HG22 ' N ' ' A' ' 16' ' ' GLU . 7.8 m -151.12 166.26 31.35 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.405 ' N ' HG22 ' A' ' 15' ' ' THR . 25.3 tt0 -56.98 -35.26 68.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.269 0.557 . . . . 0.0 110.262 179.731 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -59.96 -36.96 78.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.842 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.81 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 8.3 mm-40 -66.09 -35.76 81.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.003 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.88 -47.33 69.15 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.5 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.473 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 1.6 mptm? -55.93 -44.16 78.08 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.947 177.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.28 -33.11 74.62 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.208 0.528 . . . . 0.0 110.818 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.839 HG22 ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -76.11 -39.72 36.34 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.221 -178.416 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.754 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -72.5 -27.3 62.18 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.216 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.406 ' N ' HD12 ' A' ' 23' ' ' LEU . 31.0 t70 -59.22 -41.25 88.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.684 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.29 -47.87 25.87 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 120.867 0.365 . . . . 0.0 110.139 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.754 ' HG ' ' HA ' ' A' ' 23' ' ' LEU . 3.9 pp -67.94 -14.57 63.07 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.694 -0.403 . . . . 0.0 111.165 -178.006 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -71.01 -24.74 62.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.16 172.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -86.27 -32.75 20.94 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 168.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 78.84 36.64 28.17 Favored Glycine 0 N--CA 1.44 -1.047 0 CA-C-N 114.141 -1.39 . . . . 0.0 112.235 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.3 -62.31 1.99 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 119.106 -1.521 . . . . 0.0 112.191 -176.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 25.8 t0 -139.32 114.41 9.55 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 121.026 -0.27 . . . . 0.0 110.531 176.188 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.532 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 46.1 t80 -85.57 -37.34 19.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.081 0.467 . . . . 0.0 110.27 174.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.38 -33.07 69.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.863 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.65 -41.83 83.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.385 177.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.839 ' HB3' HG22 ' A' ' 22' ' ' VAL . 7.1 mt -60.14 -44.26 95.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.384 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.5 ' O ' ' HB2' ' A' ' 40' ' ' SER . . . -61.07 -48.0 83.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.651 -1.159 . . . . 0.0 111.809 -179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.7 mtpp -73.54 -42.53 61.6 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.356 -170.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -79.5 -57.9 3.46 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -169.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.81 ' HD3' ' HB3' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -101.38 -25.28 14.0 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.747 0.784 . . . . 0.0 112.662 -168.279 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.5 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 9.8 m -75.86 146.77 39.58 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.469 -172.426 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -80.01 2.56 23.25 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 122.033 0.92 . . . . 0.0 109.745 174.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.591 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 37.3 t70 -60.2 -16.29 31.92 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.08 -1.418 . . . . 0.0 112.382 176.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.969 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.8 pp -56.17 -16.12 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -156.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.647 ' H ' HD12 ' A' ' 44' ' ' ILE . 3.6 mp -53.39 -42.03 46.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.164 0.507 . . . . 0.0 109.963 169.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.2 m -110.15 -16.67 13.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.035 178.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.969 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -51.47 -28.21 12.61 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -176.384 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -53.59 -26.61 22.44 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 35.5 p30 -89.82 10.67 22.72 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.973 0.416 . . . . 0.0 110.974 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.56 24.04 27.03 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.815 -177.371 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 66.98 40.48 93.4 Favored Glycine 0 CA--C 1.507 -0.409 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.329 177.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.521 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 23.5 t70 -119.12 133.59 55.7 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.314 0.578 . . . . 0.0 111.353 -173.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.8 mmt -82.26 -19.88 38.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.081 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.69 -162.42 15.63 Favored Glycine 0 N--CA 1.44 -1.055 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.011 177.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.544 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 91.1 m95 -95.1 111.72 23.51 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.414 0.626 . . . . 0.0 110.906 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.894 HD13 HG12 ' A' ' 60' ' ' ILE . 2.0 pp -108.71 156.92 19.04 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.483 177.163 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.478 ' HB2' ' OG1' ' A' ' 59' ' ' THR . 17.6 mp0 -81.76 144.89 30.77 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -64.92 136.5 56.9 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.04 8.06 6.5 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 124.298 0.999 . . . . 0.0 112.731 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.478 ' OG1' ' HB2' ' A' ' 56' ' ' GLU . 62.2 p -111.39 6.07 20.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.093 0.949 . . . . 0.0 108.676 166.863 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.894 HG12 HD13 ' A' ' 55' ' ' LEU . 13.5 mt -69.47 141.02 90.32 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.381 -175.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.04 142.45 97.34 Favored 'Trans proline' 0 C--O 1.237 0.432 0 C-N-CA 122.232 1.954 . . . . 0.0 110.898 172.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.455 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 1.7 m-20 -55.04 -29.9 58.42 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.857 -169.762 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -65.56 -36.41 83.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.863 0.363 . . . . 0.0 111.106 -179.227 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.407 ' HB2' HG22 ' A' ' 60' ' ' ILE . 5.2 mp -83.66 -25.84 30.37 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.499 -0.48 . . . . 0.0 111.047 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.459 ' CG ' ' HB ' ' A' ' 60' ' ' ILE . 52.2 mtmt -73.86 -27.38 61.05 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 177.095 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -84.5 -5.78 59.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.064 0.459 . . . . 0.0 110.054 176.309 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.987 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -68.21 -28.45 67.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.697 -178.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.39 23.05 45.26 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.979 -0.629 . . . . 0.0 113.315 176.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.634 ' HB3' ' CD1' ' A' ' 90' ' ' LEU . 11.1 mt -101.98 109.57 21.33 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.484 ' HA ' ' HD2' ' A' ' 70' ' ' LYS . 15.2 tptp -102.66 -60.1 1.6 Allowed 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 119.671 -0.812 . . . . 0.0 111.996 171.548 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.665 ' O ' HD13 ' A' ' 90' ' ' LEU . 25.5 mt-10 -107.81 152.03 24.94 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.268 0.556 . . . . 0.0 112.374 -169.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.719 ' HB2' HG12 ' A' ' 93' ' ' ILE . 35.6 tttp -66.4 138.31 57.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.125 -0.943 . . . . 0.0 112.207 -167.205 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.94 -9.62 37.1 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.875 -0.678 . . . . 0.0 111.804 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.429 ' HB3' HD12 ' A' ' 90' ' ' LEU . 65.7 tt0 -91.25 114.89 27.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.029 0.442 . . . . 0.0 109.936 175.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.597 HD12 ' HB2' ' A' ' 26' ' ' LEU . 2.4 pt? -143.12 170.08 16.38 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.963 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.687 ' HB2' HD11 ' A' ' 26' ' ' LEU . 23.7 t 78.15 45.71 0.06 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 124.164 0.915 . . . . 0.0 110.159 -172.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -92.89 104.42 3.18 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 171.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 25.4 t -90.51 113.04 25.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -176.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.731 HD11 ' HA ' ' A' ' 67' ' ' ALA . 41.1 mm -103.21 114.2 42.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.81 -176.095 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.564 ' HG2' ' HE1' ' A' ' 85' ' ' PHE . 4.5 tmtm? -72.02 113.43 9.04 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.108 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 35.5 t -119.05 161.45 20.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.446 -176.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.6 m -65.94 -26.39 67.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.827 177.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 35.6 m -92.79 -5.77 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.746 -178.246 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.66 -129.65 3.77 Favored Glycine 0 CA--C 1.508 -0.378 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 -176.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.564 ' HE1' ' HG2' ' A' ' 80' ' ' LYS . 97.0 m-85 -134.05 135.26 43.21 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.058 0.456 . . . . 0.0 110.613 177.39 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.664 HD11 ' HB ' ' A' ' 10' ' ' ILE . 50.5 tp -106.15 135.33 47.81 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.351 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.697 ' HB ' HG12 ' A' ' 11' ' ' ILE . 27.5 mm -105.7 118.6 53.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 178.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.987 HG11 ' HB1' ' A' ' 67' ' ' ALA . 10.7 p -103.82 136.92 34.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-O 121.319 0.581 . . . . 0.0 109.902 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.535 ' HE ' ' HB2' ' A' ' 9' ' ' SER . 2.4 tmm_? -137.74 119.13 14.73 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.286 -173.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.665 HD13 ' O ' ' A' ' 71' ' ' GLU . 8.4 mt -77.6 109.0 11.19 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.398 176.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.573 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 32.2 t70 -79.59 -54.18 6.13 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 119.824 -0.751 . . . . 0.0 111.533 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.544 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 5.0 t70 -155.5 170.11 22.71 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.164 -177.47 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.719 HG12 ' HB2' ' A' ' 72' ' ' LYS . 32.7 mm -135.44 128.74 48.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.384 -178.53 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.699 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . 47.5 mt-30 . . . . . 0 C--N 1.326 -0.444 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 172.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo . . . . . 0 C--O 1.233 0.274 0 CA-C-O 120.838 0.266 . . . . 0.0 111.723 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -69.41 157.16 37.61 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.535 ' HG2' ' HA ' ' A' ' 56' ' ' GLU . 99.9 mtt180 -130.17 151.11 51.05 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.998 0.428 . . . . 0.0 110.448 -176.571 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.829 HG23 HG13 ' A' ' 93' ' ' ILE . 30.7 m -136.82 137.17 39.48 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.504 -178.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.563 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 62.9 ttt180 -96.95 111.83 23.86 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.345 -0.389 . . . . 0.0 109.953 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -109.79 138.32 46.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.103 0.477 . . . . 0.0 111.308 -179.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.532 ' HB2' ' CG ' ' A' ' 89' ' ' ARG . 6.5 m -112.31 132.71 54.82 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 172.511 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.577 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.7 pp -137.77 144.29 31.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 110.541 -0.17 . . . . 0.0 110.541 -176.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.675 HD11 HG11 ' A' ' 22' ' ' VAL . 6.1 pt -140.43 146.95 23.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 174.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -97.66 126.57 43.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.898 0.38 . . . . 0.0 110.828 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.717 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 12.9 p -103.03 140.37 37.37 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.475 177.411 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -64.65 -32.2 73.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.783 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.419 HG22 ' H ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -150.9 171.71 16.82 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.54 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.665 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 33.8 tt0 -62.2 -36.25 81.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.246 0.546 . . . . 0.0 109.633 -179.116 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -53.89 -40.31 66.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.667 177.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.717 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 8.6 mm-40 -69.14 -41.2 77.62 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.776 -179.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.556 ' HA ' HG21 ' A' ' 13' ' ' THR . . . -59.18 -44.85 92.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.327 177.406 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.665 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.3 mmtp -55.89 -48.0 76.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.291 176.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.06 -33.07 73.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.108 0.48 . . . . 0.0 110.972 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.675 HG11 HD11 ' A' ' 11' ' ' ILE . 79.4 t -73.73 -50.37 29.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.25 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.8 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -68.17 -30.53 69.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.138 -176.06 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.477 ' O ' ' HB2' ' A' ' 27' ' ' ASN . 12.8 t70 -64.3 -41.23 96.97 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.1 0.476 . . . . 0.0 110.235 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -76.07 -39.07 56.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.186 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.813 HD13 ' HB3' ' A' ' 75' ' ' LEU . 4.1 pp -71.87 -13.87 61.79 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.159 177.45 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 1.9 m-20 -62.91 -33.14 74.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.987 172.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -71.92 -29.75 64.63 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 121.605 0.717 . . . . 0.0 109.371 172.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.75 29.7 46.72 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.03 -0.987 . . . . 0.0 112.334 178.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.84 -63.2 1.28 Allowed Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 119.377 -1.392 . . . . 0.0 113.326 -175.486 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.408 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 9.4 t0 -139.28 115.72 10.55 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 117.241 0.521 . . . . 0.0 111.86 178.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.456 ' HA ' HD12 ' A' ' 35' ' ' LEU . 73.3 t80 -84.89 -41.07 16.32 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.791 0.329 . . . . 0.0 110.816 172.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.43 -33.47 65.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.111 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.79 -44.52 85.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.091 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.456 HD12 ' HA ' ' A' ' 32' ' ' PHE . 12.9 mt -62.54 -37.26 85.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.395 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.549 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -62.52 -48.28 80.23 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.351 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.691 ' HA ' HG22 ' A' ' 43' ' ' ILE . 54.8 mtpt -79.1 -33.86 44.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.124 -173.284 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -79.81 -55.68 4.81 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -177.077 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.842 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -97.85 -24.54 15.38 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.664 0.745 . . . . 0.0 112.919 -168.303 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.549 ' HB3' ' O ' ' A' ' 36' ' ' ALA . 43.2 t -89.6 152.29 21.47 Favored 'General case' 0 C--N 1.291 -1.953 0 O-C-N 121.133 -0.979 . . . . 0.0 113.008 -167.185 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.38 0.93 39.65 Favored 'General case' 0 C--N 1.334 -0.069 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.102 172.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.518 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 20.2 t70 -65.07 -15.99 62.97 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.501 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 1.06 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.6 pp -55.39 -16.35 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -157.634 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.472 ' N ' HD12 ' A' ' 43' ' ' ILE . 77.7 mt -51.76 -43.11 33.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.258 0.551 . . . . 0.0 109.603 167.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.9 m -109.41 -25.56 10.46 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.139 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 1.06 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -50.96 -29.0 11.05 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -174.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -53.74 -24.5 15.12 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -89.4 10.65 21.76 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.033 0.445 . . . . 0.0 110.898 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.22 22.83 31.15 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.359 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.405 ' O ' ' HA ' ' A' ' 9' ' ' SER . . . 62.21 29.19 72.26 Favored Glycine 0 C--N 1.331 0.284 0 N-CA-C 111.679 -0.568 . . . . 0.0 111.679 -178.556 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -90.56 113.58 25.62 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.289 0.566 . . . . 0.0 111.226 -172.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 96.7 mmm -75.51 -19.22 59.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.111 177.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 100.15 -149.11 18.64 Favored Glycine 0 N--CA 1.437 -1.253 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.641 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.646 ' CZ3' ' HG2' ' A' ' 94' ' ' GLN . 86.7 m95 -109.3 111.82 23.61 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.23 0.538 . . . . 0.0 111.212 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.498 ' O ' HD12 ' A' ' 55' ' ' LEU . 1.4 pp -99.0 153.12 19.1 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.679 174.696 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.535 ' HA ' ' HG2' ' A' ' 5' ' ' ARG . 21.7 mt-10 -90.51 140.28 29.88 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -67.39 149.56 50.12 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.121 -178.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.32 7.42 6.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.065 -175.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.8 p -112.18 3.91 17.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.717 0.77 . . . . 0.0 109.116 167.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.511 ' HB ' ' HD3' ' A' ' 65' ' ' LYS . 22.2 mt -87.13 136.17 34.12 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.049 -169.452 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.53 139.47 81.9 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.265 1.977 . . . . 0.0 110.718 171.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.61 -23.86 59.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.136 -172.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -54.01 -47.58 71.34 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.161 0.288 . . . . 0.0 110.892 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 mp -83.33 -23.15 32.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.636 0.255 . . . . 0.0 111.381 -178.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.511 ' HD3' ' HB ' ' A' ' 60' ' ' ILE . 32.1 mmmt -69.83 -37.53 76.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.009 0.433 . . . . 0.0 110.22 176.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -80.19 -5.27 55.81 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.219 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.77 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -57.69 -25.13 59.86 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.856 0.36 . . . . 0.0 111.918 -179.493 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.86 19.9 66.72 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.313 177.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.674 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 15.3 mt -95.43 94.12 7.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.186 0.517 . . . . 0.0 111.678 -175.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -101.22 -47.84 4.59 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.936 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.46 ' O ' HD13 ' A' ' 90' ' ' LEU . 35.6 mm-40 -84.74 129.75 34.78 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.078 -171.185 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 92' ' ' ASP . 63.3 tttm -66.31 117.66 8.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.103 0.478 . . . . 0.0 111.073 -174.036 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 102.67 -1.16 48.99 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.653 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.419 ' HB3' HD12 ' A' ' 90' ' ' LEU . 58.7 tt0 -68.54 126.63 30.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.813 ' HB3' HD13 ' A' ' 26' ' ' LEU . 62.8 mt -116.54 166.08 12.5 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.819 -174.379 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.509 ' HB2' HD11 ' A' ' 26' ' ' LEU . 12.5 t 76.33 57.82 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.877 0.846 . . . . 0.0 111.106 168.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.443 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -102.4 103.84 2.51 Favored Glycine 0 N--CA 1.439 -1.14 0 N-CA-C 110.146 -1.182 . . . . 0.0 110.146 169.433 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 26.3 t -98.97 113.06 32.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.152 0.501 . . . . 0.0 109.77 -175.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.443 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 79.2 mt -102.29 116.97 46.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.86 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -86.76 127.11 34.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.357 0.599 . . . . 0.0 111.471 -177.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.5 m -128.91 155.2 45.66 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.014 174.02 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.4 m -59.84 -27.15 66.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.949 0.404 . . . . 0.0 111.424 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 10.0 p -87.23 -17.82 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.477 -177.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 158.86 -171.19 35.45 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.964 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -112.06 140.67 46.55 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.754 0.311 . . . . 0.0 110.904 -176.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.472 HD11 ' HB ' ' A' ' 10' ' ' ILE . 34.1 tp -113.24 135.76 53.48 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.412 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.614 ' HB ' HG12 ' A' ' 11' ' ' ILE . 24.2 mm -104.7 130.69 55.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 177.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.77 HG11 ' HB1' ' A' ' 67' ' ' ALA . 13.6 p -125.18 140.76 47.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -177.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.692 ' NH2' ' HA ' ' A' ' 91' ' ' ASP . 0.2 OUTLIER -142.14 158.7 43.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.327 0.584 . . . . 0.0 110.862 177.023 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.959 HD22 HD11 ' A' ' 93' ' ' ILE . 10.8 mt -99.95 108.86 21.18 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.479 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.692 ' HA ' ' NH2' ' A' ' 89' ' ' ARG . 19.0 t70 -81.07 -54.08 5.85 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.322 -0.551 . . . . 0.0 111.826 177.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.622 ' HA ' ' HE2' ' A' ' 72' ' ' LYS . 9.1 t70 -155.98 152.99 28.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.458 -177.243 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.959 HD11 HD22 ' A' ' 90' ' ' LEU . 4.7 mp -133.1 128.32 55.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.022 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.646 ' HG2' ' CZ3' ' A' ' 54' ' ' TRP . 25.4 pt20 . . . . . 0 C--N 1.327 -0.381 0 CA-C-O 121.264 0.555 . . . . 0.0 110.993 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.446 -1.291 0 N-CA-C 110.509 -0.612 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -71.12 148.89 46.98 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.279 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.602 ' HG3' ' HB2' ' A' ' 94' ' ' GLN . 25.0 ptt180 -122.35 129.8 52.48 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.355 0.598 . . . . 0.0 109.9 176.481 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.557 HG23 HG23 ' A' ' 93' ' ' ILE . 20.6 m -120.27 141.39 50.03 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.056 -0.975 . . . . 0.0 109.987 -174.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.634 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 66.0 ttt180 -95.02 111.0 22.85 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 120.071 -0.652 . . . . 0.0 109.249 177.034 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.408 ' HE2' HD13 ' A' ' 60' ' ' ILE . 15.2 m-85 -106.91 135.08 49.07 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.381 0.61 . . . . 0.0 111.239 -178.208 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.579 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 20.4 m -112.36 134.82 53.69 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.272 -0.876 . . . . 0.0 108.846 169.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.643 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.8 pp -139.59 143.06 31.46 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -177.125 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.732 ' HA ' ' HB2' ' A' ' 42' ' ' ASP . 1.1 pt -138.04 141.76 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -96.8 117.35 30.89 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -179.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.646 HG22 ' HE3' ' A' ' 39' ' ' LYS . 2.5 p -94.36 147.88 22.78 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.384 0.612 . . . . 0.0 110.916 -175.582 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.624 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 10.8 mmmm -64.77 -33.85 76.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.649 -171.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.491 HG22 ' H ' ' A' ' 16' ' ' GLU . 10.4 m -157.36 171.16 20.89 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.491 ' H ' HG22 ' A' ' 15' ' ' THR . 29.5 tt0 -57.63 -35.4 70.44 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.248 0.547 . . . . 0.0 110.323 -179.205 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -54.0 -43.11 69.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.497 176.42 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.624 ' HG3' ' HB2' ' A' ' 14' ' ' LYS . 8.1 mm-40 -64.32 -42.4 96.34 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.39 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.506 ' CB ' HD11 ' A' ' 87' ' ' ILE . . . -62.07 -46.39 89.35 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.975 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.641 ' HD3' HD21 ' A' ' 23' ' ' LEU . 30.0 mmtp -60.43 -39.67 88.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.971 178.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.19 -31.57 72.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.008 0.432 . . . . 0.0 110.871 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 18' ' ' GLU . 81.4 t -72.92 -50.58 31.69 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.865 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.641 HD21 ' HD3' ' A' ' 20' ' ' LYS . 4.2 pp -65.72 -27.64 68.47 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.336 -176.655 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.417 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.7 t70 -64.1 -53.52 48.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.003 0.43 . . . . 0.0 110.302 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.467 ' HG2' HD21 ' A' ' 35' ' ' LEU . 1.5 tp10 -66.37 -41.4 89.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.976 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.92 HD11 ' HB2' ' A' ' 76' ' ' SER . 3.8 pp -73.08 -16.67 61.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.012 -179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.434 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -71.38 -30.68 66.41 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 175.129 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -76.02 -32.6 59.46 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 169.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 80.62 36.37 23.14 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.518 -1.219 . . . . 0.0 113.749 168.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -85.38 -63.73 1.55 Allowed Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 118.871 -1.633 . . . . 0.0 112.404 -178.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -139.95 121.23 14.92 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.824 0.312 . . . . 0.0 110.93 173.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -84.51 -32.06 24.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.095 0.474 . . . . 0.0 110.3 174.285 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.65 -35.98 71.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.087 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.32 -36.22 78.98 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.353 0.597 . . . . 0.0 110.289 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.467 HD21 ' HG2' ' A' ' 25' ' ' GLU . 6.6 mt -69.56 -32.92 71.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.242 -178.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.545 ' HB2' HG21 ' A' ' 11' ' ' ILE . . . -71.23 -46.2 61.6 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.562 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.7 mtpt -77.76 -28.75 50.68 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -168.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -79.34 -61.8 1.89 Allowed 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -169.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.646 ' HE3' HG22 ' A' ' 13' ' ' THR . 0.0 OUTLIER -104.16 -21.99 13.47 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 -179.903 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.524 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 10.4 m -75.21 143.73 43.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.205 0.526 . . . . 0.0 111.53 -168.243 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -76.84 5.84 7.13 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.778 -177.897 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.732 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 18.9 t70 -64.03 -16.26 61.27 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.243 -1.344 . . . . 0.0 111.767 176.252 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.963 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.6 pp -55.83 -15.51 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 -159.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.43 ' N ' HD12 ' A' ' 43' ' ' ILE . 66.5 mt -58.11 -44.14 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-O 121.096 0.474 . . . . 0.0 109.849 167.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -109.65 -13.84 14.45 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.931 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.963 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -53.3 -29.07 31.46 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 122.765 0.426 . . . . 0.0 111.777 178.275 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -55.08 -19.4 7.23 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.513 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.9 m-20 -89.96 0.22 57.21 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.84 0.352 . . . . 0.0 110.614 177.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.47 29.31 14.37 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.131 -0.787 . . . . 0.0 111.131 -173.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.545 ' HA2' ' OD2' ' A' ' 42' ' ' ASP . . . 80.36 -2.64 76.38 Favored Glycine 0 N--CA 1.453 -0.222 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -175.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -73.86 122.23 22.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.101 0.477 . . . . 0.0 111.846 -175.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.487 ' SD ' HG12 ' A' ' 10' ' ' ILE . 87.6 mtp -78.1 -34.46 50.13 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.149 172.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 120.15 -172.14 14.8 Favored Glycine 0 N--CA 1.438 -1.19 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.186 -174.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.531 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 94.6 m95 -89.68 120.71 31.19 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 120.824 0.345 . . . . 0.0 111.078 178.525 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.521 HD23 ' O ' ' A' ' 55' ' ' LEU . 0.6 OUTLIER -115.7 155.37 27.85 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 174.644 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -88.5 139.57 30.34 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 120.967 0.413 . . . . 0.0 109.924 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASP . . . . . 0.414 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 27.9 t0 -56.96 151.32 15.02 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.337 173.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.414 ' HB3' ' O ' ' A' ' 57' ' ' ASP . . . 72.5 7.11 5.58 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 124.319 1.012 . . . . 0.0 110.943 -172.074 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.2 m -111.53 -0.25 16.23 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 162.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.708 ' HB ' ' HE2' ' A' ' 65' ' ' LYS . 56.6 mt -88.39 115.59 63.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.62 -176.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.26 157.66 58.87 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.166 2.577 . . . . 0.0 111.65 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.624 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . 4.7 m-20 -56.79 -20.96 25.23 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.915 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.47 -52.64 64.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.478 175.155 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.447 ' O ' ' HB3' ' A' ' 67' ' ' ALA . 6.3 mp -82.93 -14.23 54.54 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.929 0.395 . . . . 0.0 110.708 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.708 ' HE2' ' HB ' ' A' ' 60' ' ' ILE . 72.2 mmtt -73.3 -34.4 65.71 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 172.592 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 -75.15 -5.8 46.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.736 174.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.956 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -74.43 -32.25 62.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.202 175.066 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 73.8 21.55 79.17 Favored Glycine 0 C--N 1.336 0.529 0 CA-C-N 115.393 -0.821 . . . . 0.0 113.016 176.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.686 HD13 ' HG ' ' A' ' 90' ' ' LEU . 12.4 mt -86.41 94.64 9.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.071 0.463 . . . . 0.0 111.396 -177.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -100.29 -54.73 2.79 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.308 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.531 ' O ' HD13 ' A' ' 90' ' ' LEU . 36.8 mt-10 -106.92 142.88 35.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.12 0.486 . . . . 0.0 111.56 -172.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.571 ' CD ' ' HA ' ' A' ' 92' ' ' ASP . 28.0 ttpp -66.74 137.12 56.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.702 -168.588 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.1 -6.28 36.82 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.586 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.596 ' HB3' HD12 ' A' ' 90' ' ' LEU . 59.1 tt0 -91.65 116.41 28.85 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.53 0.681 . . . . 0.0 110.034 176.396 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.672 ' HG ' HD13 ' A' ' 26' ' ' LEU . 2.1 pt? -139.53 169.81 17.07 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.92 ' HB2' HD11 ' A' ' 26' ' ' LEU . 37.1 t 78.87 59.98 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 122.288 1.042 . . . . 0.0 109.877 -167.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -111.7 108.6 2.33 Favored Glycine 0 N--CA 1.439 -1.103 0 CA-C-N 114.192 -1.367 . . . . 0.0 109.79 168.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 37.4 t -92.11 113.6 27.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.0 0.429 . . . . 0.0 110.415 -173.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.563 HD11 ' HB2' ' A' ' 67' ' ' ALA . 71.3 mt -106.87 122.13 60.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.828 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 58.2 tttp -85.54 128.99 34.92 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.216 0.532 . . . . 0.0 110.794 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.2 m -118.66 161.51 19.96 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 174.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 26.2 t -69.58 -28.56 66.07 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.184 0.516 . . . . 0.0 109.707 176.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 10.7 p -84.33 -12.95 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.607 -177.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 157.94 -139.22 6.22 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.749 -0.738 . . . . 0.0 111.77 -177.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -131.16 149.38 52.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 117.048 0.424 . . . . 0.0 111.075 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.618 HD11 ' HB ' ' A' ' 10' ' ' ILE . 40.3 tp -121.41 135.46 55.06 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.15 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.643 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 28.9 mm -109.97 126.37 67.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.878 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.956 HG11 ' HB1' ' A' ' 67' ' ' ALA . 7.1 p -108.3 141.87 22.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 121.102 0.477 . . . . 0.0 110.497 -177.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.579 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 1.5 tmm_? -141.21 122.04 14.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.529 -175.326 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.686 ' HG ' HD13 ' A' ' 69' ' ' LEU . 9.8 mt -77.7 108.82 11.18 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.842 176.348 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.634 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 34.3 t70 -80.8 -54.17 5.84 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 119.32 -0.952 . . . . 0.0 111.54 175.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.571 ' HA ' ' CD ' ' A' ' 72' ' ' LYS . 2.7 t70 -156.47 170.69 21.74 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.71 -177.1 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.557 HG23 HG23 ' A' ' 6' ' ' THR . 0.4 OUTLIER -137.48 136.84 46.27 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-O 121.086 0.47 . . . . 0.0 110.976 175.827 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.602 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . 84.2 mt-30 . . . . . 0 C--N 1.322 -0.599 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.554 178.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo . . . . . 0 N--CA 1.448 -1.182 0 N-CA-C 110.841 -0.484 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -70.03 155.44 40.59 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -113.95 138.54 50.21 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 120.622 -0.431 . . . . 0.0 109.923 -175.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.699 HG23 HG13 ' A' ' 93' ' ' ILE . 10.8 m -120.75 137.77 54.34 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.335 -178.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.418 ' HB2' ' CE2' ' A' ' 54' ' ' TRP . 67.8 ttt180 -101.85 111.96 24.41 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.712 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.642 ' HD2' HD21 ' A' ' 55' ' ' LEU . 17.7 m-85 -107.03 133.45 51.66 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.673 -177.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.536 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 2.6 m -98.28 132.54 43.68 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 168.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.72 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.24 147.04 21.75 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -177.199 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.757 HD11 HG11 ' A' ' 22' ' ' VAL . 3.3 pt -138.16 142.47 35.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 C-N-CA 120.423 -0.511 . . . . 0.0 109.71 177.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -97.49 115.52 27.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.094 0.473 . . . . 0.0 110.006 -177.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.43 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 77.3 p -99.01 148.93 23.5 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.398 -177.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -69.23 -34.23 74.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.77 -174.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -152.41 174.76 13.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.998 0.427 . . . . 0.0 111.923 -178.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -65.48 -26.46 67.94 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.56 -45.21 92.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.295 177.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.576 ' OE1' ' HG3' ' A' ' 39' ' ' LYS . 81.3 mm-40 -65.78 -44.86 84.49 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.635 176.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . 0.599 ' HA ' HD11 ' A' ' 87' ' ' ILE . . . -56.41 -48.04 77.76 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.427 -176.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.468 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 1.5 mptm? -64.21 -33.54 76.04 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.17 -41.5 70.27 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.085 0.469 . . . . 0.0 110.418 177.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.757 HG11 HD11 ' A' ' 11' ' ' ILE . 93.0 t -71.51 -49.17 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.368 -178.202 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.559 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.5 pp -63.01 -28.56 70.19 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.031 -176.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.47 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.1 t70 -65.88 -48.81 70.27 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.174 0.511 . . . . 0.0 109.952 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.464 ' HG2' HD21 ' A' ' 35' ' ' LEU . 6.6 tp10 -66.24 -43.98 85.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.679 -178.802 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.678 HD23 HG12 ' A' ' 22' ' ' VAL . 4.3 pp -73.43 -19.04 61.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.105 -178.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -75.0 -24.88 58.47 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.882 0.372 . . . . 0.0 110.45 176.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -71.92 -24.23 61.6 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 170.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.72 25.84 52.07 Favored Glycine 0 N--CA 1.443 -0.849 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.517 175.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.21 -63.6 1.25 Allowed Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 119.154 -1.498 . . . . 0.0 113.061 -176.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -140.07 114.81 9.47 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.255 0.528 . . . . 0.0 111.604 177.269 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.556 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 60.2 t80 -86.78 -41.34 14.17 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.325 0.583 . . . . 0.0 109.874 170.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.664 ' O ' ' HG2' ' A' ' 37' ' ' LYS . . . -58.61 -35.44 72.46 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.221 -176.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.04 -38.42 88.34 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.49 0.662 . . . . 0.0 110.355 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.577 ' HB3' HG13 ' A' ' 22' ' ' VAL . 11.6 mt -65.32 -36.21 83.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.301 178.031 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.66 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -67.41 -41.24 85.2 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.612 -1.176 . . . . 0.0 111.126 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.664 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 13.5 mmmm -69.62 -46.37 66.39 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.655 -173.184 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -59.35 2.75 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 -166.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.576 ' HG3' ' OE1' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -100.27 -21.87 15.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.109 -174.692 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.66 ' HB3' ' O ' ' A' ' 36' ' ' ALA . 35.4 t -69.08 146.38 52.63 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 120.839 0.352 . . . . 0.0 111.515 -171.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.41 0.1 43.62 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.837 0.827 . . . . 0.0 109.931 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.598 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 38.6 t70 -66.54 -16.07 63.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.329 -1.305 . . . . 0.0 112.428 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.987 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.8 pp -55.16 -16.61 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -150.693 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 65.8 mt -61.97 -39.84 85.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 118.421 0.555 . . . . 0.0 109.646 169.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m -92.2 -30.88 15.69 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.322 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.987 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -52.63 -29.53 26.63 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.335 -176.296 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -53.58 -30.98 44.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.044 0.449 . . . . 0.0 110.941 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -90.99 9.9 28.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.225 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.28 24.71 28.28 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.586 -177.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.462 ' HA2' ' OD2' ' A' ' 42' ' ' ASP . . . 83.86 8.44 84.28 Favored Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 -176.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -72.34 108.74 5.62 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.214 0.531 . . . . 0.0 111.39 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 54.2 mmm -82.48 -24.06 34.39 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.753 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 130.07 -160.36 22.9 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.036 -175.294 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.652 ' CH2' ' HG2' ' A' ' 94' ' ' GLN . 81.0 m95 -107.72 138.52 43.8 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.886 0.374 . . . . 0.0 110.993 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.642 HD21 ' HD2' ' A' ' 8' ' ' TYR . 3.5 pp -126.24 156.18 40.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.208 176.053 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -82.2 130.51 35.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.077 0.465 . . . . 0.0 110.455 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -70.29 147.05 50.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.165 178.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 71.65 7.24 5.91 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 124.34 1.025 . . . . 0.0 111.788 -176.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.1 p -111.7 2.1 17.04 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 166.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.596 ' HB ' ' HE3' ' A' ' 65' ' ' LYS . 45.6 mt -69.72 128.46 91.97 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 114.215 -1.357 . . . . 0.0 111.257 -173.267 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.98 157.01 61.57 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 122.833 2.356 . . . . 0.0 111.445 174.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.525 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . 7.4 p-10 -56.68 -21.37 27.19 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.601 -172.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.728 ' HG3' HG21 ' A' ' 79' ' ' ILE . 39.4 tt0 -56.29 -56.59 19.22 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.087 0.242 . . . . 0.0 110.614 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.406 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 4.8 mp -83.72 -16.62 44.2 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.504 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.596 ' HE3' ' HB ' ' A' ' 60' ' ' ILE . 31.8 mmtp -60.13 -35.29 74.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.217 0.532 . . . . 0.0 110.435 174.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -78.3 -5.82 53.22 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.772 -178.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.79 -32.24 46.31 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.195 0.521 . . . . 0.0 110.419 177.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 68.98 22.09 75.67 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.326 -0.852 . . . . 0.0 113.339 176.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.709 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 6.6 mt -86.81 88.49 7.69 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.004 0.43 . . . . 0.0 111.707 -174.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.421 ' HA ' ' HD2' ' A' ' 70' ' ' LYS . 23.1 tptp -100.58 -39.98 7.63 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 178.27 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -95.94 128.35 42.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.955 -174.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.635 ' HB2' HD13 ' A' ' 93' ' ' ILE . 82.6 tttt -66.58 134.73 52.95 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.151 0.501 . . . . 0.0 111.044 -172.747 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.13 -1.63 35.28 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.538 -177.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -92.16 130.77 37.8 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.166 0.507 . . . . 0.0 110.554 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.533 ' HB3' HD13 ' A' ' 26' ' ' LEU . 2.1 mp -118.82 169.77 9.57 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.691 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.2 t 78.98 60.95 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.797 0.808 . . . . 0.0 112.593 169.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -109.21 102.84 1.7 Allowed Glycine 0 N--CA 1.443 -0.849 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 163.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.406 HG21 HD23 ' A' ' 23' ' ' LEU . 19.9 t -100.46 113.88 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.482 0 CA-C-O 121.004 0.43 . . . . 0.0 110.007 -177.317 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.728 HG21 ' HG3' ' A' ' 63' ' ' GLU . 51.5 mm -109.62 127.01 66.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.7 -177.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -77.6 125.31 29.14 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.379 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.0 m -119.9 163.79 17.02 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.029 178.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.2 m -68.91 -26.4 65.07 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.25 0.548 . . . . 0.0 110.262 177.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 14.7 p -84.1 -12.54 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.238 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.7 -133.06 4.14 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.007 -0.616 . . . . 0.0 111.786 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -130.1 139.41 50.94 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.658 0.265 . . . . 0.0 110.511 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.72 HD11 ' HB ' ' A' ' 10' ' ' ILE . 29.9 tp -120.48 135.67 54.99 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -178.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.599 HD11 ' HA ' ' A' ' 19' ' ' ALA . 5.0 mt -119.23 125.88 74.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.541 HG23 HD12 ' A' ' 69' ' ' LEU . 1.8 m -113.16 145.9 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-O 121.486 0.66 . . . . 0.0 111.311 -174.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.556 ' HD3' ' CG ' ' A' ' 32' ' ' PHE . 34.3 ttp180 -134.58 145.86 49.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.196 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.864 HD22 HD11 ' A' ' 93' ' ' ILE . 14.6 mt -87.42 108.29 18.94 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.079 0.466 . . . . 0.0 111.284 179.605 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.482 ' O ' ' HE3' ' A' ' 72' ' ' LYS . 3.7 t0 -80.92 -53.76 6.17 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.897 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.409 ' C ' HD12 ' A' ' 93' ' ' ILE . 10.8 m-20 -154.51 160.36 41.51 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.113 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.864 HD11 HD22 ' A' ' 90' ' ' LEU . 3.4 mp -136.05 127.69 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 172.358 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.652 ' HG2' ' CH2' ' A' ' 54' ' ' TRP . 81.6 mm-40 . . . . . 0 C--N 1.331 -0.226 0 CA-C-O 120.768 0.318 . . . . 0.0 110.36 177.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo . . . . . 0 N--CA 1.447 -1.258 0 CA-C-O 120.797 0.249 . . . . 0.0 111.73 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -70.81 158.12 36.9 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 176.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -121.99 135.0 54.81 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 120.033 -0.667 . . . . 0.0 110.389 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.731 HG23 HG13 ' A' ' 93' ' ' ILE . 22.3 m -128.67 133.59 48.26 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.311 -177.266 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.633 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 34.1 ttt180 -95.44 111.47 23.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.646 ' HD2' HD21 ' A' ' 55' ' ' LEU . 14.7 m-85 -103.96 135.4 45.55 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.283 -178.579 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.669 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 0.7 OUTLIER -96.33 132.18 42.09 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 168.588 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.87 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.7 141.38 27.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.628 HG12 ' HB ' ' A' ' 87' ' ' ILE . 5.6 pt -140.49 149.15 21.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.228 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -103.27 113.32 26.72 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.496 -174.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.81 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 16.1 p -94.66 141.83 28.16 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.261 178.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -64.55 -30.78 71.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.782 -174.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.31 173.67 14.21 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.511 ' HG2' ' HE2' ' A' ' 20' ' ' LYS . 32.2 tt0 -64.13 -36.58 84.5 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -53.05 -39.54 63.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.979 177.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.81 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 6.1 mm-40 -67.38 -37.1 82.61 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.776 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.83 -39.52 94.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.088 179.204 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.511 ' HE2' ' HG2' ' A' ' 16' ' ' GLU . 5.1 mptp? -55.55 -48.41 74.78 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.098 176.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.13 -31.05 72.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.961 0.41 . . . . 0.0 111.126 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.513 HG11 HD11 ' A' ' 11' ' ' ILE . 94.4 t -75.68 -51.91 19.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.074 179.574 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.459 HD12 ' N ' ' A' ' 24' ' ' ASP . 4.6 pp -66.64 -27.78 67.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.252 -176.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.459 ' N ' HD12 ' A' ' 23' ' ' LEU . 28.1 t70 -64.26 -46.72 82.49 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.759 0.314 . . . . 0.0 111.209 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.456 ' HB3' HD21 ' A' ' 35' ' ' LEU . 29.9 tt0 -75.35 -40.15 58.5 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.29 -176.635 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 75' ' ' LEU . 2.8 pp -69.96 -13.66 62.34 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.661 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.452 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -69.5 -21.03 63.71 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.95 174.551 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -88.99 -26.19 21.62 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 169.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.74 33.93 26.17 Favored Glycine 0 N--CA 1.449 -0.496 0 CA-C-N 114.609 -1.178 . . . . 0.0 113.397 170.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.67 -63.41 1.48 Allowed Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 119.025 -1.559 . . . . 0.0 112.839 -176.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.521 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 3.0 m-20 -139.48 116.65 11.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.883 0.342 . . . . 0.0 111.613 177.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.526 ' HA ' HD12 ' A' ' 35' ' ' LEU . 43.3 t80 -81.71 -37.87 26.66 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 169.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.49 -37.72 65.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.834 176.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.72 -39.13 84.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.581 -178.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.526 HD12 ' HA ' ' A' ' 32' ' ' PHE . 11.4 mt -66.99 -43.04 83.99 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.196 177.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . 0.428 ' CB ' HG21 ' A' ' 11' ' ' ILE . . . -59.28 -53.29 59.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.394 -1.276 . . . . 0.0 111.892 -177.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.497 ' HA ' HG22 ' A' ' 43' ' ' ILE . 40.2 mtpt -75.66 -29.5 59.1 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.906 -169.387 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -79.92 -56.03 4.55 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.813 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 1.2 tppp? -97.66 -24.74 15.37 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -163.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.625 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 24.7 p -92.17 156.56 17.25 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.024 -1.048 . . . . 0.0 112.387 -165.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.98 6.07 19.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.335 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.466 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 13.1 t70 -75.27 -15.24 60.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.051 -0.977 . . . . 0.0 112.218 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 1.033 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.7 pp -55.8 -15.98 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -152.186 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.477 ' N ' HD12 ' A' ' 43' ' ' ILE . 58.3 mt -53.93 -37.56 34.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 118.427 0.558 . . . . 0.0 109.748 169.635 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 p -107.72 -25.09 11.45 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.483 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 1.033 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -56.65 -29.21 62.01 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 178.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 43' ' ' ILE . 99.2 mtt180 -57.87 -15.84 9.88 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.866 0.365 . . . . 0.0 111.524 176.654 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -89.65 10.73 22.08 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.654 0.74 . . . . 0.0 109.866 176.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.54 10.19 62.17 Favored Glycine 0 N--CA 1.453 -0.187 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.074 -177.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.431 ' HA2' ' HA ' ' A' ' 46' ' ' ALA . . . 96.57 -13.5 65.36 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.109 177.315 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASP . . . . . 0.539 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 47.6 m-20 -72.95 114.4 11.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.504 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 27.0 ptm -71.93 -21.81 61.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.899 -177.742 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 132.23 -159.62 23.4 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.86 -179.106 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.432 ' CH2' ' HG3' ' A' ' 94' ' ' GLN . 86.1 m95 -109.04 117.02 33.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.82 0.343 . . . . 0.0 110.633 -179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.646 HD21 ' HD2' ' A' ' 8' ' ' TYR . 2.0 pp -103.66 151.81 22.53 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.79 174.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -92.39 136.77 32.92 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.103 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -57.04 147.99 22.8 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.144 177.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.73 6.99 6.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.263 -0.881 . . . . 0.0 112.383 -178.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 p -111.81 7.45 20.18 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 163.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.646 ' HB ' ' HE3' ' A' ' 65' ' ' LYS . 36.1 mt -86.24 127.25 62.17 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.633 -174.713 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -65.91 151.74 83.31 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.445 2.096 . . . . 0.0 111.396 174.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.412 ' HA ' ' CG ' ' A' ' 65' ' ' LYS . 5.2 p-10 -59.34 -17.88 33.42 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.349 -176.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -64.04 -47.28 80.81 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.778 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.8 mp -83.4 -15.06 51.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.825 0.345 . . . . 0.0 110.659 177.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.646 ' HE3' ' HB ' ' A' ' 60' ' ' ILE . 33.2 mmtp -63.34 -30.51 71.63 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.487 0.66 . . . . 0.0 109.764 173.37 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -74.0 -11.52 60.36 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.263 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.551 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -70.49 -31.35 68.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.1 0.476 . . . . 0.0 111.151 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.47 19.3 64.43 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.751 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.713 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 18.6 mt -85.34 90.9 8.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.048 0.451 . . . . 0.0 111.142 -176.024 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -100.41 -43.49 6.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.66 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -107.64 135.31 49.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.764 0.316 . . . . 0.0 110.905 -174.43 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . 0.605 ' HD3' ' HA ' ' A' ' 92' ' ' ASP . 6.7 ttpm? -66.58 138.97 57.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.767 -171.426 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.39 -5.19 35.42 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -94.19 128.49 40.66 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.231 0.538 . . . . 0.0 110.035 177.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 26' ' ' LEU . 1.2 pp -145.14 170.91 15.31 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.902 -175.758 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.62 ' HB2' ' CD1' ' A' ' 26' ' ' LEU . 25.6 t 79.25 49.71 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.425 1.078 . . . . 0.0 110.809 -174.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.421 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -98.72 110.73 4.07 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 168.05 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.29 113.36 39.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -176.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.562 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 47.5 mm -97.0 114.84 34.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.478 -175.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.773 ' HG2' ' CE2' ' A' ' 85' ' ' PHE . 2.4 tmtp? -83.62 113.92 21.18 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.166 -174.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.7 m -122.93 167.41 13.61 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.134 176.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.5 t -84.59 -26.32 28.02 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 32.9 m -77.78 -10.45 13.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.241 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 149.24 -159.38 28.03 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.416 -0.674 . . . . 0.0 111.416 -179.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' PHE . . . . . 0.773 ' CE2' ' HG2' ' A' ' 80' ' ' LYS . 91.1 m-85 -125.66 132.5 52.42 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.848 0.356 . . . . 0.0 110.513 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.87 HD11 ' HB ' ' A' ' 10' ' ' ILE . 41.6 tp -107.19 135.37 48.84 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.147 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.663 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 22.4 mm -108.1 124.14 64.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.581 HG22 HD12 ' A' ' 69' ' ' LEU . 12.1 p -113.51 139.5 38.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.355 0.597 . . . . 0.0 111.232 -175.094 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.669 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 7.5 ttp180 -136.49 148.0 47.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.815 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.713 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.9 mt -94.72 109.42 21.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.619 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.633 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 37.1 t70 -80.46 -55.05 5.15 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 119.942 -0.703 . . . . 0.0 111.58 175.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASP . . . . . 0.605 ' HA ' ' HD3' ' A' ' 72' ' ' LYS . 35.9 t70 -157.13 160.21 38.59 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.62 0.248 . . . . 0.0 111.232 177.59 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.731 HG13 HG23 ' A' ' 6' ' ' THR . 3.8 mp -124.73 127.1 72.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 172.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLN . . . . . 0.432 ' HG3' ' CH2' ' A' ' 54' ' ' TRP . 82.3 mt-30 . . . . . 0 C--N 1.327 -0.408 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -176.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.6 m . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 121.07 0.462 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.548 ' HB2' ' HD2' ' A' ' 3' ' ' PRO . 17.5 pt20 -145.73 168.36 12.02 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -178.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.548 ' HD2' ' HB2' ' A' ' 2' ' ' GLN . 73.2 Cg_endo -79.65 133.59 10.51 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.694 2.263 . . . . 0.0 113.429 -175.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.492 ' HG3' ' HB2' ' A' ' 57' ' ' ASP . 13.1 pt20 -70.74 160.15 33.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.323 172.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.483 ' HB2' ' CG ' ' A' ' 94' ' ' GLN . 99.3 mtt180 -122.59 151.18 41.68 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.995 0.426 . . . . 0.0 111.024 -177.109 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.659 HG23 HD13 ' A' ' 93' ' ' ILE . 32.2 m -135.19 136.04 41.49 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.516 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.632 ' HD3' ' OD1' ' A' ' 91' ' ' ASP . 63.3 ttt180 -100.84 111.39 23.6 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.793 ' HD2' HD21 ' A' ' 55' ' ' LEU . 19.5 m-85 -106.84 141.06 38.67 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.742 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.498 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 14.7 m -112.84 131.95 55.49 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 169.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.615 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.7 pp -142.59 141.58 27.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 N-CA-C 110.369 -0.234 . . . . 0.0 110.369 -173.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.706 HD11 HG11 ' A' ' 22' ' ' VAL . 10.5 pt -140.42 144.87 26.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -103.37 128.97 50.33 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.924 0.392 . . . . 0.0 110.743 -176.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.725 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 10.9 p -109.0 156.21 20.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.186 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.502 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 71.9 mmtt -65.62 -49.1 69.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.379 -179.168 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.99 175.61 9.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.557 -177.284 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.684 ' HG2' ' HD3' ' A' ' 20' ' ' LYS . 26.7 tt0 -63.4 -31.32 72.44 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 176.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -56.62 -45.66 81.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.363 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.725 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 8.4 mm-40 -65.5 -43.01 91.49 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.97 179.088 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.82 -47.43 85.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.915 178.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.684 ' HD3' ' HG2' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -56.63 -40.85 76.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 175.639 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.92 -37.55 87.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.125 0.488 . . . . 0.0 110.689 177.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.706 HG11 HD11 ' A' ' 11' ' ' ILE . 73.5 t -71.59 -48.23 53.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.371 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.715 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -70.74 -27.85 64.27 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.324 -176.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -61.79 -43.61 98.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.079 0.466 . . . . 0.0 110.16 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.447 ' HG2' HD21 ' A' ' 35' ' ' LEU . 7.5 tp10 -69.66 -46.2 66.68 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.642 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.842 HD13 HD13 ' A' ' 75' ' ' LEU . 3.5 pp -73.0 -13.91 61.32 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.457 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.422 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -66.65 -28.2 68.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.188 0.518 . . . . 0.0 110.125 175.517 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -74.92 -32.19 61.73 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 170.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.14 36.11 13.64 Favored Glycine 0 N--CA 1.444 -0.776 0 CA-C-N 114.555 -1.202 . . . . 0.0 113.24 171.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.79 -64.16 1.26 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 118.877 -1.63 . . . . 0.0 112.741 -178.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -140.31 122.6 15.91 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.904 174.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.619 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 59.3 t80 -84.5 -38.13 20.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.008 0.432 . . . . 0.0 110.232 171.305 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.58 -38.41 66.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.838 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.49 ' O ' ' HG3' ' A' ' 38' ' ' GLU . . . -64.75 -42.85 94.84 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.504 0.669 . . . . 0.0 110.418 -178.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.447 HD21 ' HG2' ' A' ' 25' ' ' GLU . 9.8 mt -64.07 -36.44 84.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.448 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.595 ' HA ' HG21 ' A' ' 11' ' ' ILE . . . -63.29 -43.85 96.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.309 -1.314 . . . . 0.0 112.174 -176.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.404 ' HG3' ' HA ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -77.5 -30.17 52.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.945 -173.772 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 43.6 mt-10 -79.39 -57.81 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -170.365 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.589 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -99.32 -26.44 14.16 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.655 0.74 . . . . 0.0 112.276 -171.266 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.578 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 37.1 t -67.65 137.56 55.68 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -170.17 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.25 1.03 38.61 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.662 171.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.461 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 24.9 t70 -69.85 -14.87 62.96 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.952 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 1.05 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.3 pp -54.6 -14.72 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -155.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.889 ' H ' HD12 ' A' ' 44' ' ' ILE . 3.6 mp -51.18 -37.9 18.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 167.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.8 m -109.92 -32.93 6.87 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.816 174.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 1.05 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -54.58 -29.26 50.95 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.547 ' HG3' ' O ' ' A' ' 43' ' ' ILE . 80.4 mtp180 -59.34 -15.1 14.24 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 117.718 0.236 . . . . 0.0 111.44 178.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -83.69 9.64 11.2 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.974 0.416 . . . . 0.0 110.536 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.1 26.17 22.35 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 111.605 -0.598 . . . . 0.0 111.605 -176.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 83.64 -8.06 66.97 Favored Glycine 0 C--N 1.329 0.181 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -73.26 116.22 13.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.889 0.376 . . . . 0.0 111.184 -177.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.584 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 26.0 ptm -82.24 -19.38 39.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.697 176.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 118.24 177.0 17.0 Favored Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.957 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.568 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 72.2 m95 -84.37 114.68 22.05 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.682 0.277 . . . . 0.0 110.781 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.793 HD21 ' HD2' ' A' ' 8' ' ' TYR . 3.1 pp -98.01 155.72 16.97 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.594 175.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.43 ' HG2' ' HG2' ' A' ' 5' ' ' ARG . 35.5 mt-10 -96.63 145.33 25.85 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.492 ' HB2' ' HG3' ' A' ' 4' ' ' GLN . 13.8 t70 -65.13 141.2 58.78 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -176.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 72.14 9.22 5.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.335 -177.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 15.8 p -110.45 -0.1 17.6 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 167.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.715 HG12 HD13 ' A' ' 55' ' ' LEU . 25.0 mt -71.55 129.87 88.09 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.945 -176.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.446 ' HG2' HD13 ' A' ' 64' ' ' LEU . 30.1 Cg_endo -65.03 148.89 89.82 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.487 2.125 . . . . 0.0 111.169 173.042 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.678 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 0.8 OUTLIER -56.43 -25.24 49.75 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.462 -175.121 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.21 -49.74 75.05 Favored 'General case' 0 C--N 1.319 -0.743 0 O-C-N 123.41 0.444 . . . . 0.0 110.51 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.446 HD13 ' HG2' ' A' ' 61' ' ' PRO . 6.0 mp -83.42 -15.29 50.27 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.678 ' HD2' ' HA ' ' A' ' 62' ' ' ASP . 97.3 mttt -61.48 -31.97 71.97 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.449 0.642 . . . . 0.0 109.879 174.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -83.53 -5.37 59.15 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.6 -178.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.759 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -69.08 -32.01 71.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.007 0.432 . . . . 0.0 111.598 -178.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 70.19 17.7 74.23 Favored Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.477 174.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.709 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 15.3 mt -91.68 84.49 5.46 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -176.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.459 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 40.4 mmtm -102.73 -22.77 13.88 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 174.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -94.07 120.24 34.05 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.475 0.178 . . . . 0.0 111.157 -178.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.6 tttp -66.42 130.15 42.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.039 0.447 . . . . 0.0 111.452 -171.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.27 -12.49 40.19 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 111.224 -0.751 . . . . 0.0 111.224 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.9 tt0 -78.23 122.29 25.5 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.106 0.479 . . . . 0.0 110.227 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.842 HD13 HD13 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -133.01 169.59 16.61 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.525 -179.673 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.697 ' HB2' HD11 ' A' ' 26' ' ' LEU . 23.1 t 77.99 53.24 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 124.178 0.924 . . . . 0.0 110.297 -174.726 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -101.11 108.77 3.5 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 110.227 -1.149 . . . . 0.0 110.227 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.2 t -99.17 113.72 34.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.144 0.497 . . . . 0.0 109.972 -176.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.472 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 69.2 mt -98.93 115.29 39.09 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.071 -178.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.576 ' HG2' ' HE2' ' A' ' 85' ' ' PHE . 1.5 tmtp? -81.19 113.66 19.49 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.905 -175.643 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.0 t -125.78 160.84 28.76 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 12.2 t -74.4 -26.28 59.99 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.156 0.503 . . . . 0.0 109.893 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 25.8 m -79.65 -10.12 12.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.988 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.16 -163.99 27.32 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 111.099 -0.8 . . . . 0.0 111.099 -178.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.576 ' HE2' ' HG2' ' A' ' 80' ' ' LYS . 96.7 m-85 -116.39 129.53 56.29 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.061 0.458 . . . . 0.0 110.892 -176.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.602 HD11 ' HB ' ' A' ' 10' ' ' ILE . 48.4 tp -103.93 135.06 46.16 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.875 -178.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.615 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 22.4 mm -107.64 121.4 60.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.144 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.759 HG11 ' HB1' ' A' ' 67' ' ' ALA . 14.8 p -110.5 137.48 42.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 CA-C-O 121.206 0.527 . . . . 0.0 111.024 -176.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.778 ' HG3' ' HB3' ' A' ' 75' ' ' LEU . 7.0 ttp180 -132.14 144.61 50.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.975 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.709 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 10.6 mt -93.22 110.47 21.98 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.359 177.136 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.632 ' OD1' ' HD3' ' A' ' 7' ' ' ARG . 17.5 t70 -79.06 -54.33 6.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.812 177.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.568 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 6.5 t70 -156.17 165.91 35.0 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.713 0.292 . . . . 0.0 111.529 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.659 HD13 HG23 ' A' ' 6' ' ' THR . 32.9 mm -130.81 128.98 63.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.778 -0.647 . . . . 0.0 109.409 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.483 ' CG ' ' HB2' ' A' ' 5' ' ' ARG . 10.5 pt20 -130.28 131.82 45.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.078 0.466 . . . . 0.0 110.375 176.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -88.72 54.3 2.98 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.238 177.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 72.01 -66.55 0.3 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.366 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' HIS . . . . . 0.752 ' HA ' ' HB2' ' A' ' 102' ' ' HIS . 31.3 t60 -63.2 -27.12 69.14 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -173.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' HIS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 94' ' ' GLN . 6.1 t-80 -68.72 95.3 0.65 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -169.336 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -179.76 -64.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 174.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 30.1 t60 -149.02 -59.65 0.22 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.073 -0.967 . . . . 0.0 108.551 174.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 31.4 t60 -162.99 114.23 1.48 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.354 172.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.752 ' HB2' ' HA ' ' A' ' 97' ' ' HIS . 73.5 m-70 . . . . . 0 C--O 1.248 0.991 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 168.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 8.6 t . . . . . 0 N--CA 1.479 0.991 0 CA-C-O 120.889 0.376 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -119.03 135.61 23.91 Favored Pre-proline 0 N--CA 1.45 -0.465 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 177.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -85.46 145.63 9.42 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.728 2.285 . . . . 0.0 112.108 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.643 ' CB ' ' HA ' ' A' ' 95' ' ' ALA . 13.8 pt20 -70.35 158.83 35.24 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 175.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.505 ' HG2' ' HA ' ' A' ' 56' ' ' GLU . 99.4 mtt180 -128.28 148.28 50.64 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.305 0.574 . . . . 0.0 111.596 -170.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.647 HG23 HD13 ' A' ' 93' ' ' ILE . 69.8 m -123.16 136.13 54.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.518 -177.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.422 ' HB2' ' CE2' ' A' ' 54' ' ' TRP . 68.5 ttt180 -99.93 111.69 23.99 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.174 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.757 ' HD2' HD21 ' A' ' 55' ' ' LEU . 12.4 m-85 -104.61 138.33 41.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.366 0.603 . . . . 0.0 111.549 -178.431 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.732 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 19.4 m -111.56 133.41 53.85 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 170.047 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.665 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.33 145.68 23.35 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.04 -174.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.68 HG12 ' HB ' ' A' ' 87' ' ' ILE . 3.3 pt -139.75 148.18 23.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -99.65 112.63 24.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.914 0.387 . . . . 0.0 110.667 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 21.7 p -96.12 144.84 26.0 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.186 176.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -84.88 -21.36 29.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.997 -169.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.485 ' O ' ' HB2' ' A' ' 18' ' ' GLU . 4.1 m -147.65 164.57 33.11 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.264 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.571 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 26.9 tt0 -69.71 -27.28 64.86 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.17 -39.47 82.61 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.477 172.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.619 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 5.8 mm-40 -64.23 -41.09 97.16 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.935 -1.029 . . . . 0.0 110.165 175.51 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.57 ' O ' ' HG ' ' A' ' 23' ' ' LEU . . . -63.18 -47.29 83.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.669 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 16' ' ' GLU . 74.4 mmtt -55.01 -44.11 74.25 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.156 0.503 . . . . 0.0 110.789 178.132 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.99 -37.07 72.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.151 -179.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.612 HG22 ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -76.2 -38.38 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.745 -175.416 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 19' ' ' ALA . 4.2 pp -72.61 -28.42 62.77 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 121.104 -0.239 . . . . 0.0 111.279 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.524 ' N ' HD12 ' A' ' 23' ' ' LEU . 30.3 t70 -58.01 -41.12 82.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.674 0.274 . . . . 0.0 111.553 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.672 ' HB3' HD21 ' A' ' 35' ' ' LEU . 0.7 OUTLIER -71.37 -44.04 65.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.104 0.478 . . . . 0.0 109.855 -179.367 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.593 ' HB3' ' CD1' ' A' ' 35' ' ' LEU . 3.8 pp -73.16 -16.94 61.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.674 -178.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -72.89 -25.01 60.92 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.235 0.54 . . . . 0.0 109.667 172.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -84.96 -24.55 28.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.918 0.866 . . . . 0.0 108.784 170.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.03 39.91 36.45 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 114.104 -1.407 . . . . 0.0 112.486 175.293 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.47 -64.46 1.44 Allowed Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 118.526 -1.797 . . . . 0.0 112.512 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.479 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 45.3 t0 -141.8 114.98 8.79 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 117.142 0.471 . . . . 0.0 111.127 170.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.631 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 32.8 t80 -77.47 -31.98 54.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.107 0.48 . . . . 0.0 109.747 173.687 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.475 ' HB1' ' HA2' ' A' ' 49' ' ' GLY . . . -64.62 -31.64 72.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.712 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.65 -40.85 84.52 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.357 0.599 . . . . 0.0 109.944 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' A' ' 25' ' ' GLU . 14.0 mt -62.25 -44.89 95.51 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.458 178.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.533 ' O ' ' HB2' ' A' ' 40' ' ' SER . . . -56.99 -47.48 80.69 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.592 -1.185 . . . . 0.0 111.529 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.525 ' HG2' ' HA ' ' A' ' 47' ' ' ARG . 39.4 mtpt -79.89 -32.99 40.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.153 -172.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -80.36 -60.7 2.22 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -169.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.619 ' HD3' ' HB3' ' A' ' 18' ' ' GLU . 1.1 ttmm -103.11 -25.05 13.54 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.984 0.897 . . . . 0.0 112.813 -170.612 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.564 ' O ' HG23 ' A' ' 43' ' ' ILE . 7.5 m -75.31 143.34 42.98 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.519 -169.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -79.19 1.61 23.96 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.611 0.719 . . . . 0.0 110.24 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.568 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 27.8 t70 -65.82 -16.65 64.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.395 176.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 1.014 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 3.5 pt -56.21 -17.88 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 114.579 1.325 . . . . 0.0 114.579 -157.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 71.0 mt -51.74 -39.8 25.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.268 0.556 . . . . 0.0 110.014 167.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 35.4 t -112.41 -28.96 7.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.345 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 1.014 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -51.71 -29.36 18.09 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -175.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.525 ' HA ' ' HG2' ' A' ' 37' ' ' LYS . 89.8 mtt180 -63.71 -8.84 11.44 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.354 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.8 p30 -90.38 10.32 25.49 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.958 0.409 . . . . 0.0 110.991 170.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.475 ' HA2' ' HB1' ' A' ' 33' ' ' ALA . . . 92.26 26.51 18.24 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 116.141 -0.482 . . . . 0.0 112.976 -176.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.42 20.06 79.79 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 121.62 -0.324 . . . . 0.0 113.364 173.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -97.0 122.94 40.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.014 0.435 . . . . 0.0 111.033 -176.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.548 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 27.0 ptm -82.68 -19.67 37.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.834 176.357 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 113.69 -171.22 13.69 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.0 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.535 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 84.4 m95 -90.68 125.47 35.67 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.004 0.43 . . . . 0.0 111.143 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.757 HD21 ' HD2' ' A' ' 8' ' ' TYR . 2.7 pp -115.33 156.51 25.36 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 173.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.516 ' O ' ' HB ' ' A' ' 59' ' ' THR . 25.3 mt-10 -81.67 132.26 35.29 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.964 0.412 . . . . 0.0 110.092 -177.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.62 ' HB3' ' HG3' ' A' ' 4' ' ' GLN . 31.9 t70 -73.22 145.32 46.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.277 -175.22 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 62.9 7.56 2.69 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.422 -172.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 56' ' ' GLU . 13.6 m -112.11 3.01 17.03 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.337 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.701 HG12 HD13 ' A' ' 55' ' ' LEU . 21.8 mt -73.59 133.59 79.88 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 113.835 -1.53 . . . . 0.0 110.865 -173.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.75 155.61 53.11 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.801 2.334 . . . . 0.0 111.839 174.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.664 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 8.9 m-20 -55.54 -27.51 49.31 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.048 -0.978 . . . . 0.0 112.708 -171.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.97 -55.49 32.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.936 178.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.514 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 5.2 mp -83.45 -16.59 45.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.532 -177.362 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.664 ' HD2' ' HA ' ' A' ' 62' ' ' ASP . 67.6 mttm -56.86 -44.12 81.85 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.602 0.715 . . . . 0.0 109.602 172.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -75.67 -5.34 45.09 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.017 -176.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.838 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -71.33 -31.09 66.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.037 0.446 . . . . 0.0 111.049 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 77.48 19.08 76.92 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.935 175.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.717 HD12 HG22 ' A' ' 88' ' ' VAL . 11.8 mt -96.11 87.26 4.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.839 0.352 . . . . 0.0 111.309 -177.465 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -100.69 -41.44 6.91 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -177.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.513 ' O ' HD13 ' A' ' 90' ' ' LEU . 31.5 tt0 -100.32 135.33 41.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.853 0.358 . . . . 0.0 111.351 -174.142 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.477 ' HE3' ' O ' ' A' ' 91' ' ' ASP . 1.6 tmtp? -66.48 135.39 54.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.522 -170.338 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.58 -11.96 39.08 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.495 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.513 ' HB3' HD12 ' A' ' 90' ' ' LEU . 64.3 tt0 -83.9 127.8 34.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.159 0.504 . . . . 0.0 110.705 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.586 HD13 HD12 ' A' ' 26' ' ' LEU . 1.4 pp -138.27 170.3 16.27 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.345 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.9 t 78.64 60.37 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 124.106 0.879 . . . . 0.0 111.093 -178.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -110.88 120.31 5.49 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 170.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 25.8 t -107.91 113.51 43.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.216 0.531 . . . . 0.0 110.346 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.489 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 43.9 mm -103.84 118.12 50.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.249 -178.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 85' ' ' PHE . 86.4 tttt -82.87 130.32 35.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.402 0.62 . . . . 0.0 111.164 -178.081 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.3 m -126.96 166.92 16.62 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.041 173.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.3 m -79.04 -26.02 43.16 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.496 0.665 . . . . 0.0 109.337 177.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 33.6 m -85.47 -5.84 10.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.531 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.25 -157.24 27.12 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.884 -0.675 . . . . 0.0 111.851 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.535 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 83.1 m-85 -124.85 136.55 53.91 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 117.035 0.417 . . . . 0.0 110.333 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.665 HD11 ' HB ' ' A' ' 10' ' ' ILE . 57.1 tp -107.78 135.49 49.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.775 0.321 . . . . 0.0 110.382 -178.533 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.68 ' HB ' HG12 ' A' ' 11' ' ' ILE . 24.9 mm -108.95 127.55 65.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.461 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.838 HG11 ' HB1' ' A' ' 67' ' ' ALA . 11.1 p -112.78 141.01 29.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.268 0.556 . . . . 0.0 110.542 -176.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.732 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 1.5 tmm_? -142.16 130.92 22.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.879 -174.227 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.676 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.8 mt -87.4 109.68 19.74 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 120.702 0.287 . . . . 0.0 111.31 178.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.477 ' O ' ' HE3' ' A' ' 72' ' ' LYS . 11.9 t70 -79.42 -53.92 6.43 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.662 177.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.535 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 28.7 t0 -156.0 164.52 38.35 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.932 -0.307 . . . . 0.0 111.781 -178.387 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.647 HD13 HG23 ' A' ' 6' ' ' THR . 26.6 mm -134.65 123.84 42.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.125 176.448 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.683 ' HB2' ' HB2' ' A' ' 98' ' ' HIS . 28.9 pt20 -136.96 134.72 37.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.025 0.441 . . . . 0.0 110.603 178.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.643 ' HA ' ' CB ' ' A' ' 4' ' ' GLN . . . -83.27 62.1 6.49 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.892 0.377 . . . . 0.0 110.637 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.581 ' O ' ' HB3' ' A' ' 102' ' ' HIS . . . 63.76 -84.33 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.817 -177.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -87.4 87.24 7.36 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.209 0.528 . . . . 0.0 109.893 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' HIS . . . . . 0.683 ' HB2' ' HB2' ' A' ' 94' ' ' GLN . 69.1 t60 -98.05 49.9 1.01 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.962 -175.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.405 ' O ' ' HB2' ' A' ' 100' ' ' HIS . 95.7 m-70 53.93 87.73 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.807 173.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 99' ' ' HIS . 43.2 m80 75.05 -27.23 0.19 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.142 0.577 . . . . 0.0 112.394 174.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -71.44 -29.43 64.86 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 172.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.581 ' HB3' ' O ' ' A' ' 96' ' ' ALA . 5.9 t60 . . . . . 0 C--O 1.246 0.912 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.478 0.932 0 CA-C-O 120.809 0.338 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -72.14 141.95 84.36 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.004 176.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -79.55 140.34 14.94 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.647 2.231 . . . . 0.0 112.891 -174.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.42 ' OE1' ' HA ' ' A' ' 96' ' ' ALA . 6.0 pt20 -75.59 158.65 32.18 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.132 176.311 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.491 ' HE ' ' HG2' ' A' ' 56' ' ' GLU . 99.7 mtt180 -121.85 145.73 47.79 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.437 0.637 . . . . 0.0 112.11 -171.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 26.1 m -135.09 141.22 46.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.384 -176.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.586 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 57.3 ttt180 -100.4 111.91 24.22 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 177.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.5 ' HE1' ' HB3' ' A' ' 69' ' ' LEU . 23.1 m-85 -106.67 139.67 40.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.154 0.502 . . . . 0.0 111.569 -178.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 50' ' ' GLY . 9.8 m -117.49 132.38 56.56 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 171.616 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.69 ' HB ' HD21 ' A' ' 86' ' ' LEU . 2.7 pp -140.69 145.31 25.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -174.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.637 HG21 ' HA ' ' A' ' 36' ' ' ALA . 7.3 pt -140.46 138.56 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -98.13 118.32 34.48 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.986 0.422 . . . . 0.0 110.163 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.736 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 52.7 p -94.34 149.65 21.03 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.246 174.089 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.54 ' HB2' ' OE2' ' A' ' 18' ' ' GLU . 25.2 mttp -77.75 -25.47 49.21 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.497 -173.21 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -141.97 168.25 20.2 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.357 176.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.432 ' HB2' ' CZ ' ' A' ' 85' ' ' PHE . 23.9 tt0 -64.68 -32.95 74.84 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -53.71 -41.68 67.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.632 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.736 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 49.9 mt-10 -69.68 -41.31 75.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.384 178.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.545 ' HA ' HD11 ' A' ' 87' ' ' ILE . . . -59.41 -39.1 82.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.405 178.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -55.32 -50.91 68.39 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.812 0.339 . . . . 0.0 110.775 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.21 -30.87 70.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.08 -177.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.815 HG22 ' HE3' ' A' ' 39' ' ' LYS . 21.9 t -75.51 -52.2 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.899 -0.592 . . . . 0.0 109.806 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.438 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -66.48 -28.45 68.59 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.051 -176.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.419 ' N ' HD12 ' A' ' 23' ' ' LEU . 17.8 t70 -64.24 -44.2 92.56 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.025 0.441 . . . . 0.0 110.369 175.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.421 ' HG2' HD21 ' A' ' 35' ' ' LEU . 4.2 tp10 -75.53 -45.45 38.01 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.98 -175.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.863 HD13 HD13 ' A' ' 75' ' ' LEU . 3.1 pp -72.55 -14.93 61.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.746 0.308 . . . . 0.0 110.984 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.481 ' N ' HD12 ' A' ' 26' ' ' LEU . 1.0 OUTLIER -63.01 -27.69 69.59 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 174.009 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.03 -25.62 17.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.767 0.794 . . . . 0.0 109.373 173.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.45 45.63 13.75 Favored Glycine 0 N--CA 1.448 -0.514 0 CA-C-N 114.597 -1.183 . . . . 0.0 113.879 168.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.28 -64.26 1.66 Allowed Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 118.706 -1.711 . . . . 0.0 112.593 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.515 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 45.3 t0 -141.1 115.91 9.71 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 117.109 0.454 . . . . 0.0 111.474 171.458 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.412 ' HA ' HD12 ' A' ' 35' ' ' LEU . 60.8 t80 -77.19 -33.14 56.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.817 0.342 . . . . 0.0 110.374 174.466 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.3 -30.34 71.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.815 -177.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.6 -42.21 71.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.425 0.631 . . . . 0.0 109.552 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 31' ' ' ASP . 13.0 mt -61.28 -45.05 96.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.1 -0.954 . . . . 0.0 109.258 176.089 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.637 ' HA ' HG21 ' A' ' 11' ' ' ILE . . . -56.19 -51.05 69.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.31 -1.314 . . . . 0.0 112.244 -176.59 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.669 ' HG2' ' HA ' ' A' ' 47' ' ' ARG . 54.0 mtpt -78.21 -22.65 48.2 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.782 -170.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -80.09 -59.8 2.58 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.815 ' HE3' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -103.33 -22.88 13.63 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -171.834 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.417 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 0.7 OUTLIER -75.18 147.67 40.23 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.413 -163.704 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.15 4.12 24.49 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.826 0.822 . . . . 0.0 109.651 174.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.797 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 14.6 t70 -68.92 -15.05 63.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.383 -1.281 . . . . 0.0 112.146 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.973 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.4 pp -54.81 -14.97 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -153.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.859 ' H ' HD12 ' A' ' 44' ' ' ILE . 4.1 mp -51.62 -40.48 25.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 166.641 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.7 p -120.04 -6.16 9.99 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.675 177.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.973 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -71.39 -29.88 65.45 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.923 -0.486 . . . . 0.0 111.091 179.4 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.669 ' HA ' ' HG2' ' A' ' 37' ' ' LYS . 79.7 mtp180 -59.09 -28.58 66.63 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.668 -177.356 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.407 HD22 ' HB3' ' A' ' 51' ' ' ASP . 2.8 p-10 -90.09 13.24 15.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.131 0.491 . . . . 0.0 110.903 176.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.59 21.87 30.43 Favored Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.959 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.413 ' O ' ' HA ' ' A' ' 9' ' ' SER . . . 72.37 11.34 76.02 Favored Glycine 0 C--N 1.327 0.062 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.185 175.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.407 ' HB3' HD22 ' A' ' 48' ' ' ASN . 4.4 t70 -76.3 115.76 16.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.341 -0.429 . . . . 0.0 110.781 -178.412 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.528 ' SD ' HG12 ' A' ' 10' ' ' ILE . 88.1 mtp -79.6 -20.94 45.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.319 0.58 . . . . 0.0 109.606 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 107.83 -162.17 13.3 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.046 -177.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -95.55 119.26 33.74 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.904 0.383 . . . . 0.0 110.811 178.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.482 HD13 ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -108.7 155.85 20.25 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.193 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.491 ' HG2' ' HE ' ' A' ' 5' ' ' ARG . 40.2 mt-10 -93.99 131.07 39.82 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.532 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -61.53 148.94 40.45 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.402 -174.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 63.87 6.77 2.9 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.711 -174.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 5.1 m -112.18 -0.74 15.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 122.24 1.019 . . . . 0.0 108.764 168.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.651 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 24.3 mt -75.2 137.61 72.07 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.524 -175.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.52 ' HG2' HD13 ' A' ' 64' ' ' LEU . 18.8 Cg_endo -61.37 146.12 97.54 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.345 2.03 . . . . 0.0 111.244 174.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.646 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 7.8 p-10 -56.59 -24.0 44.53 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.251 -172.308 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -57.64 -49.03 77.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.356 0.41 . . . . 0.0 110.802 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.52 HD13 ' HG2' ' A' ' 61' ' ' PRO . 6.4 mp -83.1 -15.34 51.23 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.317 -178.185 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.651 ' HE3' ' O ' ' A' ' 60' ' ' ILE . 94.2 mttt -64.08 -34.32 77.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.584 0.707 . . . . 0.0 110.089 174.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -71.8 -5.72 36.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.527 -178.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.618 ' HB1' HD13 ' A' ' 69' ' ' LEU . . . -70.85 -39.16 73.12 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.088 0.47 . . . . 0.0 111.227 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 72.13 15.4 76.62 Favored Glycine 0 C--N 1.332 0.345 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.132 -174.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.622 ' C ' HD11 ' A' ' 90' ' ' LEU . 6.7 mp -81.33 78.69 8.09 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -174.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.406 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 70.7 mmtt -102.44 -16.62 16.12 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 175.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -109.08 125.52 52.22 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 122.214 -0.304 . . . . 0.0 111.278 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.799 ' HB2' HD13 ' A' ' 93' ' ' ILE . 87.5 tttt -66.11 133.4 50.65 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.22 0.533 . . . . 0.0 112.139 -169.725 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 101.58 -3.88 53.73 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.253 -177.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.646 ' HB3' HD12 ' A' ' 90' ' ' LEU . 64.6 tt0 -80.44 114.43 19.34 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 121.31 0.576 . . . . 0.0 109.722 175.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.863 HD13 HD13 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -133.64 169.78 16.52 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.911 178.8 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.618 ' HB2' HD11 ' A' ' 26' ' ' LEU . 18.5 t 78.56 46.2 0.05 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 122.007 0.908 . . . . 0.0 110.358 -174.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -96.96 103.74 2.95 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 167.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 17.7 t -103.09 113.13 38.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -174.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 59.9 mt -94.1 109.43 22.03 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.602 -177.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.428 ' HD2' ' HE2' ' A' ' 85' ' ' PHE . 26.0 tttt -75.28 113.69 12.95 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.391 -174.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.561 ' HB2' ' O ' ' A' ' 84' ' ' GLY . 14.9 m -126.75 137.87 53.3 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.403 -1.271 . . . . 0.0 107.936 173.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.8 p -62.47 -26.02 68.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.352 -175.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 19.9 m -79.59 -19.4 12.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.297 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . 0.561 ' O ' ' HB2' ' A' ' 81' ' ' SER . . . 161.08 163.59 14.38 Favored Glycine 0 N--CA 1.444 -0.787 0 N-CA-C 111.006 -0.837 . . . . 0.0 111.006 -175.045 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.432 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 57.8 m-85 -109.6 127.96 54.88 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 120.77 0.319 . . . . 0.0 110.798 -172.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.69 HD21 ' HB ' ' A' ' 10' ' ' ILE . 1.2 tt -111.16 138.49 47.54 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 121.545 0.688 . . . . 0.0 110.666 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.591 ' N ' HD23 ' A' ' 86' ' ' LEU . 6.5 mt -117.46 121.37 67.42 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 CA-C-N 114.557 -1.202 . . . . 0.0 110.588 -175.052 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.54 HG22 HD22 ' A' ' 69' ' ' LEU . 7.1 p -113.06 141.38 28.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.667 -176.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.724 ' HB2' ' HB3' ' A' ' 75' ' ' LEU . 2.8 ptm180 -138.45 158.31 44.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.449 0.642 . . . . 0.0 110.72 174.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.871 HD22 HD11 ' A' ' 93' ' ' ILE . 12.9 mt -96.57 109.6 22.17 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.207 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.586 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 21.7 t70 -79.56 -53.91 6.41 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.052 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.486 ' C ' HD12 ' A' ' 93' ' ' ILE . 43.2 t0 -155.03 160.57 41.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.741 -177.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.871 HD11 HD22 ' A' ' 90' ' ' LEU . 1.7 mp -128.87 136.05 60.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.092 -0.503 . . . . 0.0 109.879 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -127.16 119.8 27.3 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.871 0.367 . . . . 0.0 111.322 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . 63.97 24.19 13.54 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.241 175.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.61 ' HB3' HG23 ' A' ' 93' ' ' ILE . . . -112.21 -75.89 0.6 Allowed 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.933 177.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' HIS . . . . . 0.484 ' H ' HG21 ' A' ' 93' ' ' ILE . 29.7 t-80 -151.21 116.17 5.25 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 175.308 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -128.75 -78.03 0.56 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.217 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -146.27 -39.15 0.22 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.917 0.389 . . . . 0.0 110.415 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -72.91 167.17 21.56 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.66 173.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 55.1 t60 -69.38 93.06 0.63 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -171.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 8.8 t-80 . . . . . 0 C--O 1.242 0.665 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 171.03 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 2.5 m . . . . . 0 N--CA 1.477 0.923 0 CA-C-O 121.403 0.62 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -172.97 157.6 3.29 Favored Pre-proline 0 N--CA 1.452 -0.368 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.068 -176.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -89.62 109.39 0.43 Allowed 'Trans proline' 0 N--CA 1.446 -1.305 0 C-N-CA 123.017 2.478 . . . . 0.0 111.482 177.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.615 ' HG3' ' HB3' ' A' ' 57' ' ' ASP . 12.7 pt20 -80.74 158.8 25.39 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.663 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 49.6 mtt180 -128.99 151.21 49.93 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.08 0.467 . . . . 0.0 111.51 -171.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.9 m -128.62 131.12 48.08 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.717 176.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.539 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 58.8 ttt180 -95.61 111.74 23.61 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.68 -0.408 . . . . 0.0 109.9 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.681 ' HD2' HD21 ' A' ' 55' ' ' LEU . 22.4 m-85 -106.43 146.47 30.47 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.481 0.658 . . . . 0.0 111.131 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.471 ' HB2' ' HE ' ' A' ' 89' ' ' ARG . 16.2 m -125.86 132.52 52.17 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 169.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.676 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.9 pp -136.67 149.14 26.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 -175.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.678 HD11 HG11 ' A' ' 22' ' ' VAL . 5.3 pt -140.32 147.59 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 177.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -103.99 121.32 42.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.386 -176.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.779 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 73.8 p -97.86 153.76 18.1 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.61 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -84.9 -25.57 27.85 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.219 -175.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.0 m -149.9 165.24 33.19 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 176.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.688 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 30.6 tt0 -56.12 -39.34 72.07 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.047 0.451 . . . . 0.0 110.384 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -57.53 -38.6 74.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.918 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.976 ' HB3' ' HD2' ' A' ' 39' ' ' LYS . 10.9 mm-40 -64.89 -36.28 83.85 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.82 -176.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.629 ' HA ' HD11 ' A' ' 87' ' ' ILE . . . -70.69 -38.61 73.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.595 178.361 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.688 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.0 mmtp -58.51 -43.66 89.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.308 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.06 -34.27 77.64 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.817 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.678 HG11 HD11 ' A' ' 11' ' ' ILE . 92.1 t -73.52 -49.25 37.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.331 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.669 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.5 pp -65.72 -28.54 69.13 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.215 -176.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.453 ' N ' HD12 ' A' ' 23' ' ' LEU . 19.2 t70 -63.8 -46.47 85.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.097 0.475 . . . . 0.0 110.412 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -75.07 -38.85 61.18 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.854 -175.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.115 HD11 ' HB3' ' A' ' 76' ' ' SER . 2.7 pp -72.71 -17.09 61.66 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.153 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.509 ' N ' HD12 ' A' ' 26' ' ' LEU . 2.0 m-80 -69.35 -21.16 63.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.121 0.486 . . . . 0.0 110.139 175.111 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -77.63 -26.2 50.36 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 172.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.13 31.32 52.96 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-N 114.486 -1.234 . . . . 0.0 112.627 173.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -91.2 -64.11 1.18 Allowed Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 118.758 -1.687 . . . . 0.0 113.301 -177.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.452 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 8.0 t0 -140.1 115.47 9.94 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 122.76 -0.259 . . . . 0.0 111.351 177.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.481 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 93.1 t80 -85.4 -41.31 15.55 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.96 0.41 . . . . 0.0 110.893 172.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.74 -33.81 61.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.259 -178.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.32 -44.52 75.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.311 178.298 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 31' ' ' ASP . 12.4 mt -60.57 -38.36 84.33 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.636 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.54 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -59.53 -50.93 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.502 179.166 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -69.61 -35.33 75.17 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.921 -173.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.49 -55.48 5.18 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -175.54 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.976 ' HD2' ' HB3' ' A' ' 18' ' ' GLU . 1.0 OUTLIER -96.73 -24.04 16.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.701 0.762 . . . . 0.0 112.869 -166.373 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.629 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 29.0 t -93.44 147.38 23.01 Favored 'General case' 0 C--N 1.291 -1.94 0 O-C-N 121.514 -0.741 . . . . 0.0 112.93 -167.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.53 0.62 41.76 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.11 174.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.663 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 31.4 t70 -59.87 -14.69 16.44 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.46 -1.246 . . . . 0.0 112.666 178.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 1.046 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.5 pp -54.73 -14.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -152.326 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.431 ' N ' HD12 ' A' ' 43' ' ' ILE . 44.3 mm -51.82 -33.04 15.19 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 CA-C-O 121.378 0.608 . . . . 0.0 109.539 165.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.8 m -119.62 -20.39 7.73 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.212 174.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 1.046 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -64.32 -29.98 71.04 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 121.84 -0.537 . . . . 0.0 111.767 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -57.15 -34.28 68.25 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.603 0.239 . . . . 0.0 111.521 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -88.71 13.87 11.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.233 0.54 . . . . 0.0 110.934 176.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.78 24.66 22.6 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.342 -0.844 . . . . 0.0 113.049 178.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.02 14.2 76.1 Favored Glycine 0 CA--C 1.51 -0.254 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.129 174.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -85.58 115.8 23.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.897 0.379 . . . . 0.0 110.311 -176.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.426 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 26.1 ptm -80.64 -19.62 44.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.118 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 115.02 -166.61 12.18 Favored Glycine 0 N--CA 1.439 -1.128 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.737 -178.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.792 ' CZ3' ' HB2' ' A' ' 94' ' ' GLN . 82.4 m95 -98.85 113.37 25.46 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.914 0.387 . . . . 0.0 111.081 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.725 HD13 HG12 ' A' ' 60' ' ' ILE . 2.6 pp -99.64 153.31 19.17 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.372 173.457 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -84.92 132.72 34.34 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.615 ' HB3' ' HG3' ' A' ' 4' ' ' GLN . 23.8 t70 -67.56 145.39 54.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.292 -175.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 65.4 7.13 4.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.903 -173.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.8 m -112.72 9.32 19.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 122.032 0.92 . . . . 0.0 108.828 166.095 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.725 HG12 HD13 ' A' ' 55' ' ' LEU . 6.0 mt -81.94 137.79 46.64 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.705 -172.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 60' ' ' ILE . 31.9 Cg_exo -61.27 152.36 72.77 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.742 2.295 . . . . 0.0 111.582 176.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.03 -25.26 66.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.77 -168.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.552 ' HA ' ' ND2' ' A' ' 66' ' ' ASN . 41.1 tt0 -70.01 -25.88 63.8 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.377 0.608 . . . . 0.0 110.257 177.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.598 ' HB2' HG22 ' A' ' 60' ' ' ILE . 4.4 mm? -80.93 -22.85 39.33 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.116 176.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -72.97 -44.75 60.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.541 178.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASN . . . . . 0.552 ' ND2' ' HA ' ' A' ' 63' ' ' GLU . 5.0 p30 -74.46 -6.06 46.14 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.967 0.413 . . . . 0.0 110.435 -177.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.954 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -62.83 -32.22 73.38 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.402 173.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.22 26.82 54.28 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.889 175.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.684 HD12 HG22 ' A' ' 88' ' ' VAL . 10.3 mt -102.64 86.88 2.85 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.839 0.352 . . . . 0.0 111.714 -176.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -101.25 -41.9 6.53 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.671 176.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -94.18 127.87 40.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.92 0.391 . . . . 0.0 111.825 -175.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.836 ' HE2' ' HA ' ' A' ' 92' ' ' ASP . 51.0 tttm -66.71 133.77 50.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.267 -172.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.04 -8.41 38.79 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.25 -0.74 . . . . 0.0 111.25 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -86.93 128.09 35.06 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.143 0.497 . . . . 0.0 109.996 178.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.677 HD12 ' HB2' ' A' ' 26' ' ' LEU . 2.2 pt? -144.62 169.9 17.1 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.823 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . 1.115 ' HB3' HD11 ' A' ' 26' ' ' LEU . 57.4 p 78.1 45.79 0.06 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.476 1.51 . . . . 0.0 111.266 -171.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -91.56 103.98 3.11 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 168.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 16.8 t -97.96 113.6 33.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.172 0.51 . . . . 0.0 109.855 -174.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.6 HD11 ' HA ' ' A' ' 67' ' ' ALA . 49.9 mm -103.99 124.07 58.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.439 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -82.56 126.23 32.04 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.132 0.491 . . . . 0.0 110.51 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.7 t -129.53 158.84 38.13 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 175.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.5 p -66.37 -25.84 66.98 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.958 0.409 . . . . 0.0 110.764 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 34.9 m -83.27 -11.36 11.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.423 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.95 -161.39 27.82 Favored Glycine 0 C--O 1.226 -0.366 0 N-CA-C 111.502 -0.639 . . . . 0.0 111.502 -177.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.599 ' HB2' ' OG1' ' A' ' 13' ' ' THR . 95.3 m-85 -111.14 138.68 47.27 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 117.334 0.567 . . . . 0.0 110.842 -178.225 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.676 HD11 ' HB ' ' A' ' 10' ' ' ILE . 36.2 tp -114.53 135.71 53.82 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.944 -177.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.629 HD11 ' HA ' ' A' ' 19' ' ' ALA . 15.7 mt -113.23 121.21 65.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.306 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.954 HG11 ' HB1' ' A' ' 67' ' ' ALA . 14.8 p -106.28 140.42 24.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.071 -175.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.481 ' HD3' ' CG ' ' A' ' 32' ' ' PHE . 15.3 ttp85 -132.23 141.79 49.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.792 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.665 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.0 mt -94.55 108.83 20.77 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.448 175.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.539 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 22.6 t70 -80.62 -54.98 5.17 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.098 -0.641 . . . . 0.0 111.815 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.836 ' HA ' ' HE2' ' A' ' 72' ' ' LYS . 9.1 t70 -156.63 170.13 23.1 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.165 -174.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.43 HG12 ' HB2' ' A' ' 72' ' ' LYS . 45.5 mm -127.59 120.05 53.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.792 ' HB2' ' CZ3' ' A' ' 54' ' ' TRP . 6.9 tt0 -102.3 133.93 46.41 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -169.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . 73.27 -37.38 0.38 Allowed 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 166.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -52.8 102.17 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.595 0.559 . . . . 0.0 112.168 -174.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 70.79 -6.54 1.23 Allowed 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.82 0.7 . . . . 0.0 110.96 178.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -79.55 -29.19 41.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.145 -176.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 66.7 m80 -98.6 29.1 3.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.771 176.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 47.3 t60 68.94 3.7 4.13 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.216 0.531 . . . . 0.0 110.848 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -132.13 134.3 45.28 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.328 0.585 . . . . 0.0 111.957 -178.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 . . . . . 0 C--O 1.249 1.038 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.735 173.92 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 121.099 0.476 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -116.68 165.03 16.2 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 175.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -79.5 143.23 16.95 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.139 1.892 . . . . 0.0 112.11 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.511 ' HB2' ' HA ' ' A' ' 95' ' ' ALA . 12.9 pt20 -70.31 158.46 35.88 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.632 ' HE ' ' HG2' ' A' ' 56' ' ' GLU . 99.1 mtt180 -122.31 135.39 54.72 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.47 0.652 . . . . 0.0 111.741 -173.186 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.632 HG23 HD13 ' A' ' 93' ' ' ILE . 32.0 m -120.46 137.42 54.35 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.205 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.553 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 62.8 ttt180 -96.25 110.88 23.1 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 177.374 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.694 ' HD2' HD21 ' A' ' 55' ' ' LEU . 19.2 m-85 -109.27 137.59 46.92 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.144 0.497 . . . . 0.0 111.328 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.701 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 15.3 m -109.8 132.31 54.27 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.464 -0.789 . . . . 0.0 108.913 169.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.739 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.9 pp -142.73 143.82 25.08 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -177.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.688 HD11 HG11 ' A' ' 22' ' ' VAL . 12.4 pt -140.18 146.57 24.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.24 175.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -97.41 118.74 34.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.102 0.477 . . . . 0.0 110.386 -177.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.518 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 41.3 p -98.06 154.56 17.64 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.516 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.674 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 72.7 mmtt -67.2 -37.63 83.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.024 -176.41 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.453 HG22 ' H ' ' A' ' 16' ' ' GLU . 2.7 m -152.37 171.32 18.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.835 -176.19 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.579 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 39.3 tt0 -61.7 -35.26 77.51 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-O 121.219 0.533 . . . . 0.0 109.677 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -56.32 -43.27 78.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.413 175.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.674 ' HG3' ' HB2' ' A' ' 14' ' ' LYS . 6.5 mm-40 -61.52 -41.21 96.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.33 177.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.585 ' HB1' HD11 ' A' ' 87' ' ' ILE . . . -60.78 -41.6 95.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.698 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.579 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.5 mmtp -55.63 -49.07 73.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.563 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -31.41 72.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.016 0.436 . . . . 0.0 111.022 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.688 HG11 HD11 ' A' ' 11' ' ' ILE . 62.8 t -73.78 -51.28 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.172 178.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.602 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 4.5 pp -65.45 -30.67 71.48 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.595 -174.227 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.535 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 15.3 t70 -57.18 -53.99 51.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.942 0.401 . . . . 0.0 110.798 -178.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -73.79 -33.69 64.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.638 -175.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.748 HD11 ' HB2' ' A' ' 76' ' ' SER . 3.6 pp -73.17 -21.25 60.73 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.345 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -70.53 -30.2 66.88 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.052 0.453 . . . . 0.0 109.978 172.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -69.43 -31.6 70.03 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 171.656 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.28 33.12 29.57 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.773 -1.103 . . . . 0.0 113.049 171.153 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.56 -64.3 1.21 Allowed Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 118.932 -1.604 . . . . 0.0 112.887 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -140.54 118.66 11.95 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.049 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.57 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 32.0 t80 -84.34 -31.21 24.93 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 175.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.456 ' CB ' ' HA2' ' A' ' 49' ' ' GLY . . . -60.68 -34.44 74.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.071 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.77 88.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.319 0.581 . . . . 0.0 110.084 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.701 ' CD1' ' HB3' ' A' ' 26' ' ' LEU . 6.6 mt -66.35 -42.87 87.44 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.94 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.51 ' CB ' HG21 ' A' ' 11' ' ' ILE . . . -64.06 -54.42 34.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.596 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.412 ' HA ' HG22 ' A' ' 43' ' ' ILE . 40.0 mtpt -70.16 -32.07 69.85 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.215 -169.368 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -81.18 -60.01 2.44 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 2.5 ttmm -102.16 -26.03 13.5 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 116.101 1.889 . . . . 0.0 116.101 -167.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.435 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 52.8 p -81.08 162.17 23.85 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 121.536 -0.728 . . . . 0.0 112.833 -170.679 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.7 3.43 29.12 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.194 174.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.521 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 36.1 t70 -71.46 -16.29 62.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.444 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.96 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.9 pp -56.18 -16.44 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -157.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.733 ' H ' HD12 ' A' ' 44' ' ' ILE . 4.1 mp -57.57 -41.09 78.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.117 0.484 . . . . 0.0 109.936 170.391 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.5 m -109.43 -14.35 14.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.294 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.96 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -53.04 -28.69 25.75 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.836 0.454 . . . . 0.0 112.142 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 87.8 mtt180 -53.45 -26.71 21.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.319 178.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASN . . . . . 0.487 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 85.9 m-20 -79.43 -0.38 32.73 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.86 0.362 . . . . 0.0 110.885 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.456 ' HA2' ' CB ' ' A' ' 33' ' ' ALA . . . 90.89 33.25 8.41 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 111.359 -0.697 . . . . 0.0 111.359 -173.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.535 ' O ' ' HA ' ' A' ' 9' ' ' SER . . . 71.33 11.01 70.95 Favored Glycine 0 C--N 1.334 0.434 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -175.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.487 ' HB3' ' HB3' ' A' ' 48' ' ' ASN . 9.4 t70 -76.74 119.28 20.3 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.124 -0.538 . . . . 0.0 111.924 -172.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 77.9 mmm -77.66 -21.4 52.19 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.495 172.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 102.8 -169.49 19.18 Favored Glycine 0 N--CA 1.437 -1.27 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.011 -176.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.479 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 93.8 m95 -88.13 112.75 23.04 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.181 0.515 . . . . 0.0 110.824 178.026 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.694 HD21 ' HD2' ' A' ' 8' ' ' TYR . 2.9 pp -105.14 154.7 19.83 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.686 177.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.632 ' HG2' ' HE ' ' A' ' 5' ' ' ARG . 22.8 mt-10 -88.39 127.99 35.51 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -64.12 151.35 43.44 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 73.02 8.9 5.41 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.02 0.825 . . . . 0.0 111.544 -175.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.2 p -111.49 -0.17 16.3 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 164.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.472 ' CG2' ' HB2' ' A' ' 64' ' ' LEU . 59.5 mt -78.18 129.91 73.91 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.6 -171.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 60' ' ' ILE . 20.8 Cg_exo -66.77 156.97 63.48 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 123.138 2.559 . . . . 0.0 111.916 175.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.67 -26.86 57.45 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.16 -0.927 . . . . 0.0 112.521 -173.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.465 ' HG3' HG21 ' A' ' 79' ' ' ILE . 0.4 OUTLIER -55.74 -52.37 64.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.369 . . . . 0.0 110.795 177.323 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.472 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 6.0 mp -83.09 -12.47 57.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.942 -178.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -67.33 -49.09 65.51 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 172.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -68.05 -13.36 62.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.346 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.846 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -64.67 -27.83 69.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.18 0.514 . . . . 0.0 110.84 177.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 65.38 27.04 72.03 Favored Glycine 0 C--N 1.334 0.462 0 CA-C-N 115.123 -0.944 . . . . 0.0 113.373 174.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.72 HD12 HG22 ' A' ' 88' ' ' VAL . 12.5 mt -97.15 71.22 2.41 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.8 0.333 . . . . 0.0 111.778 -175.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.444 ' HD3' ' HA ' ' A' ' 70' ' ' LYS . 44.2 mmtm -101.97 -25.74 13.66 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.779 0.323 . . . . 0.0 111.663 175.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -92.96 120.94 33.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.844 ' HD2' ' HA ' ' A' ' 92' ' ' ASP . 37.3 ttpt -67.1 144.69 55.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.263 0.554 . . . . 0.0 111.95 -170.037 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 99.91 -16.3 58.59 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.382 -177.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.435 ' HB3' HD12 ' A' ' 90' ' ' LEU . 63.0 tt0 -81.58 122.89 28.16 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.156 0.503 . . . . 0.0 110.407 -178.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.723 HD13 HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -142.27 169.63 17.23 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.775 -178.493 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.748 ' HB2' HD11 ' A' ' 26' ' ' LEU . 30.8 t 78.49 56.12 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 O-C-N 124.277 0.986 . . . . 0.0 110.775 -176.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -102.83 117.06 5.66 Favored Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 109.919 -1.272 . . . . 0.0 109.919 169.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 14.3 t -99.24 113.45 34.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.002 0.429 . . . . 0.0 109.957 -174.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.465 HG21 ' HG3' ' A' ' 63' ' ' GLU . 38.9 mm -110.64 120.27 61.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.258 -179.313 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -81.68 132.02 35.28 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.064 0.459 . . . . 0.0 111.059 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.0 m -114.93 167.09 11.09 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.49 -0.777 . . . . 0.0 108.917 172.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.5 t -72.46 -26.32 61.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.005 0.431 . . . . 0.0 109.866 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.6 m -97.64 -5.54 9.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.265 -177.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.77 -155.77 27.22 Favored Glycine 0 C--O 1.227 -0.342 0 C-N-CA 120.346 -0.93 . . . . 0.0 112.47 -178.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.492 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 82.1 m-85 -127.28 134.73 50.0 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.0 110.782 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.739 HD11 ' HB ' ' A' ' 10' ' ' ILE . 51.0 tp -110.53 135.47 51.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.438 -177.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.685 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 34.7 mm -107.45 126.77 63.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.961 178.045 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.846 HG11 ' HB1' ' A' ' 67' ' ' ALA . 11.7 p -108.12 140.61 25.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.056 0.455 . . . . 0.0 110.53 -178.238 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.716 ' HG2' ' HB3' ' A' ' 75' ' ' LEU . 2.5 tmm_? -142.31 133.21 25.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.654 -174.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.717 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 12.7 mt -89.09 109.7 20.51 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 176.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.553 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 20.2 t70 -80.44 -54.14 5.96 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.358 176.383 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.844 ' HA ' ' HD2' ' A' ' 72' ' ' LYS . 28.3 t70 -155.35 168.7 26.24 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.545 -179.429 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.632 HD13 HG23 ' A' ' 6' ' ' THR . 31.4 mm -129.97 131.09 66.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.13 -179.05 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -134.63 134.37 41.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.729 0.3 . . . . 0.0 110.629 178.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.511 ' HA ' ' HB2' ' A' ' 4' ' ' GLN . . . -90.31 34.41 0.87 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.135 0.493 . . . . 0.0 109.848 172.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 71.32 -61.39 0.49 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.78 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' HIS . . . . . 1.047 ' HA ' ' HA ' ' A' ' 102' ' ' HIS . 38.1 p-80 -148.06 104.63 3.57 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.587 0.708 . . . . 0.0 110.114 175.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' HIS . . . . . 0.484 ' H ' ' C ' ' A' ' 102' ' ' HIS . 11.7 t-160 -66.78 -53.02 37.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.337 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -116.42 -74.05 0.62 Allowed 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.399 -0.521 . . . . 0.0 111.154 -177.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 13.3 t-160 -118.01 -72.52 0.68 Allowed 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.963 -176.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -77.5 -52.24 9.41 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.01 0.433 . . . . 0.0 110.12 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 1.047 ' HA ' ' HA ' ' A' ' 97' ' ' HIS . 8.5 p80 . . . . . 0 C--O 1.242 0.677 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 173.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 15.3 t . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.531 ' HB2' ' HB2' ' A' ' 97' ' ' HIS . 26.6 mp0 -114.29 141.79 27.02 Favored Pre-proline 0 C--N 1.326 -0.422 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 178.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.513 ' HD3' ' HA ' ' A' ' 2' ' ' GLN . 1.0 OUTLIER -83.95 142.52 10.02 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 123.478 2.786 . . . . 0.0 112.05 -178.885 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.408 ' HA ' ' HB3' ' A' ' 96' ' ' ALA . 12.1 pt20 -70.66 158.95 35.32 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 175.159 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.699 ' HG3' ' HB2' ' A' ' 94' ' ' GLN . 23.9 ptt180 -121.54 139.28 53.71 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.162 -0.615 . . . . 0.0 112.0 -176.135 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.59 HG23 HD13 ' A' ' 93' ' ' ILE . 85.6 m -126.1 141.13 52.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.863 -175.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.573 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 56.9 ttt180 -101.42 121.41 41.89 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.748 ' HD2' HD21 ' A' ' 55' ' ' LEU . 25.0 m-85 -115.52 130.66 56.95 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.122 0.487 . . . . 0.0 111.886 -178.414 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.535 ' HB2' ' HE ' ' A' ' 89' ' ' ARG . 16.5 m -112.31 136.31 51.91 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 173.532 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.664 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.31 146.11 22.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 110.262 -0.273 . . . . 0.0 110.262 -175.083 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.697 HG12 ' HB ' ' A' ' 87' ' ' ILE . 3.0 pt -140.39 143.03 30.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 176.248 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -99.71 128.33 45.81 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.724 0.297 . . . . 0.0 110.53 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.616 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 11.5 p -103.69 153.82 20.23 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 -178.56 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -76.94 -31.99 57.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.976 -177.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.405 HG22 ' N ' ' A' ' 16' ' ' GLU . 7.8 m -151.12 166.26 31.35 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.405 ' N ' HG22 ' A' ' 15' ' ' THR . 25.3 tt0 -56.98 -35.26 68.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.269 0.557 . . . . 0.0 110.262 179.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -59.96 -36.96 78.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.842 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.81 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 8.3 mm-40 -66.09 -35.76 81.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.003 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.88 -47.33 69.15 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.5 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.473 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 1.6 mptm? -55.93 -44.16 78.08 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.947 177.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.28 -33.11 74.62 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.208 0.528 . . . . 0.0 110.818 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.839 HG22 ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -76.11 -39.72 36.34 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.221 -178.416 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.754 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -72.5 -27.3 62.18 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.216 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.406 ' N ' HD12 ' A' ' 23' ' ' LEU . 31.0 t70 -59.22 -41.25 88.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.684 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.29 -47.87 25.87 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 120.867 0.365 . . . . 0.0 110.139 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.754 ' HG ' ' HA ' ' A' ' 23' ' ' LEU . 3.9 pp -67.94 -14.57 63.07 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.694 -0.403 . . . . 0.0 111.165 -178.006 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -71.01 -24.74 62.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.16 172.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -86.27 -32.75 20.94 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 168.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 78.84 36.64 28.17 Favored Glycine 0 N--CA 1.44 -1.047 0 CA-C-N 114.141 -1.39 . . . . 0.0 112.235 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.3 -62.31 1.99 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 119.106 -1.521 . . . . 0.0 112.191 -176.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 25.8 t0 -139.32 114.41 9.55 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 121.026 -0.27 . . . . 0.0 110.531 176.188 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.532 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 46.1 t80 -85.57 -37.34 19.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.081 0.467 . . . . 0.0 110.27 174.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.38 -33.07 69.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.863 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.65 -41.83 83.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.385 177.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.839 ' HB3' HG22 ' A' ' 22' ' ' VAL . 7.1 mt -60.14 -44.26 95.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.384 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.5 ' O ' ' HB2' ' A' ' 40' ' ' SER . . . -61.07 -48.0 83.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.651 -1.159 . . . . 0.0 111.809 -179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.7 mtpp -73.54 -42.53 61.6 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.356 -170.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -79.5 -57.9 3.46 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -169.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.81 ' HD3' ' HB3' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -101.38 -25.28 14.0 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.747 0.784 . . . . 0.0 112.662 -168.279 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.5 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 9.8 m -75.86 146.77 39.58 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.469 -172.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -80.01 2.56 23.25 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 122.033 0.92 . . . . 0.0 109.745 174.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.591 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 37.3 t70 -60.2 -16.29 31.92 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.08 -1.418 . . . . 0.0 112.382 176.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.969 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.8 pp -56.17 -16.12 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -156.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.647 ' H ' HD12 ' A' ' 44' ' ' ILE . 3.6 mp -53.39 -42.03 46.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.164 0.507 . . . . 0.0 109.963 169.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.2 m -110.15 -16.67 13.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.035 178.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.969 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -51.47 -28.21 12.61 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -176.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -53.59 -26.61 22.44 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 35.5 p30 -89.82 10.67 22.72 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.973 0.416 . . . . 0.0 110.974 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.56 24.04 27.03 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.815 -177.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 66.98 40.48 93.4 Favored Glycine 0 CA--C 1.507 -0.409 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.329 177.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.521 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 23.5 t70 -119.12 133.59 55.7 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.314 0.578 . . . . 0.0 111.353 -173.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.8 mmt -82.26 -19.88 38.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.081 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.69 -162.42 15.63 Favored Glycine 0 N--CA 1.44 -1.055 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.011 177.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.544 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 91.1 m95 -95.1 111.72 23.51 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.414 0.626 . . . . 0.0 110.906 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.894 HD13 HG12 ' A' ' 60' ' ' ILE . 2.0 pp -108.71 156.92 19.04 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.483 177.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.478 ' HB2' ' OG1' ' A' ' 59' ' ' THR . 17.6 mp0 -81.76 144.89 30.77 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -64.92 136.5 56.9 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.04 8.06 6.5 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 124.298 0.999 . . . . 0.0 112.731 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.478 ' OG1' ' HB2' ' A' ' 56' ' ' GLU . 62.2 p -111.39 6.07 20.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.093 0.949 . . . . 0.0 108.676 166.863 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.894 HG12 HD13 ' A' ' 55' ' ' LEU . 13.5 mt -69.47 141.02 90.32 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.381 -175.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.04 142.45 97.34 Favored 'Trans proline' 0 C--O 1.237 0.432 0 C-N-CA 122.232 1.954 . . . . 0.0 110.898 172.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.455 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 1.7 m-20 -55.04 -29.9 58.42 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.857 -169.762 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -65.56 -36.41 83.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.863 0.363 . . . . 0.0 111.106 -179.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.407 ' HB2' HG22 ' A' ' 60' ' ' ILE . 5.2 mp -83.66 -25.84 30.37 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.499 -0.48 . . . . 0.0 111.047 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.459 ' CG ' ' HB ' ' A' ' 60' ' ' ILE . 52.2 mtmt -73.86 -27.38 61.05 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 177.095 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -84.5 -5.78 59.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.064 0.459 . . . . 0.0 110.054 176.309 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.987 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -68.21 -28.45 67.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.697 -178.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.39 23.05 45.26 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.979 -0.629 . . . . 0.0 113.315 176.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.634 ' HB3' ' CD1' ' A' ' 90' ' ' LEU . 11.1 mt -101.98 109.57 21.33 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.484 ' HA ' ' HD2' ' A' ' 70' ' ' LYS . 15.2 tptp -102.66 -60.1 1.6 Allowed 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 119.671 -0.812 . . . . 0.0 111.996 171.548 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.665 ' O ' HD13 ' A' ' 90' ' ' LEU . 25.5 mt-10 -107.81 152.03 24.94 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.268 0.556 . . . . 0.0 112.374 -169.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.719 ' HB2' HG12 ' A' ' 93' ' ' ILE . 35.6 tttp -66.4 138.31 57.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.125 -0.943 . . . . 0.0 112.207 -167.205 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.94 -9.62 37.1 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.875 -0.678 . . . . 0.0 111.804 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.429 ' HB3' HD12 ' A' ' 90' ' ' LEU . 65.7 tt0 -91.25 114.89 27.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.029 0.442 . . . . 0.0 109.936 175.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.597 HD12 ' HB2' ' A' ' 26' ' ' LEU . 2.4 pt? -143.12 170.08 16.38 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.963 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.687 ' HB2' HD11 ' A' ' 26' ' ' LEU . 23.7 t 78.15 45.71 0.06 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 124.164 0.915 . . . . 0.0 110.159 -172.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -92.89 104.42 3.18 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 171.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 25.4 t -90.51 113.04 25.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -176.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.731 HD11 ' HA ' ' A' ' 67' ' ' ALA . 41.1 mm -103.21 114.2 42.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.81 -176.095 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.564 ' HG2' ' HE1' ' A' ' 85' ' ' PHE . 4.5 tmtm? -72.02 113.43 9.04 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.108 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 35.5 t -119.05 161.45 20.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.446 -176.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.6 m -65.94 -26.39 67.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.827 177.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 35.6 m -92.79 -5.77 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.746 -178.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.66 -129.65 3.77 Favored Glycine 0 CA--C 1.508 -0.378 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 -176.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.564 ' HE1' ' HG2' ' A' ' 80' ' ' LYS . 97.0 m-85 -134.05 135.26 43.21 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.058 0.456 . . . . 0.0 110.613 177.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.664 HD11 ' HB ' ' A' ' 10' ' ' ILE . 50.5 tp -106.15 135.33 47.81 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.351 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.697 ' HB ' HG12 ' A' ' 11' ' ' ILE . 27.5 mm -105.7 118.6 53.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 178.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.987 HG11 ' HB1' ' A' ' 67' ' ' ALA . 10.7 p -103.82 136.92 34.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-O 121.319 0.581 . . . . 0.0 109.902 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.535 ' HE ' ' HB2' ' A' ' 9' ' ' SER . 2.4 tmm_? -137.74 119.13 14.73 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.286 -173.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.665 HD13 ' O ' ' A' ' 71' ' ' GLU . 8.4 mt -77.6 109.0 11.19 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.398 176.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.573 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 32.2 t70 -79.59 -54.18 6.13 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 119.824 -0.751 . . . . 0.0 111.533 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.544 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 5.0 t70 -155.5 170.11 22.71 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.164 -177.47 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.719 HG12 ' HB2' ' A' ' 72' ' ' LYS . 32.7 mm -135.44 128.74 48.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.384 -178.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.699 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . 47.5 mt-30 -119.31 118.67 31.86 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 172.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.52 75.97 10.1 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.44 0.638 . . . . 0.0 109.86 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.408 ' HB3' ' HA ' ' A' ' 4' ' ' GLN . . . -59.52 136.64 58.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.219 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' HIS . . . . . 0.592 ' H ' ' HB3' ' A' ' 102' ' ' HIS . 85.3 t60 75.35 115.4 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.282 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 4.5 m-70 -145.73 -44.81 0.21 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.582 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -176.29 -72.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.364 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -112.89 -20.67 11.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.679 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -66.06 -39.51 90.14 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.311 0.577 . . . . 0.0 109.687 174.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.592 ' HB3' ' H ' ' A' ' 97' ' ' HIS . 2.6 t-80 . . . . . 0 C--O 1.246 0.897 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 178.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 28.0 m . . . . . 0 N--CA 1.476 0.837 0 CA-C-O 120.807 0.337 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.428 ' HG2' ' HB1' ' A' ' 96' ' ' ALA . 0.0 OUTLIER -90.3 135.06 30.14 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-O 121.722 0.772 . . . . 0.0 111.713 -177.379 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -78.78 151.41 24.72 Favored 'Trans proline' 0 C--N 1.33 -0.425 0 C-N-CA 124.211 3.274 . . . . 0.0 111.723 176.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -69.41 157.16 37.61 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.535 ' HG2' ' HA ' ' A' ' 56' ' ' GLU . 99.9 mtt180 -130.17 151.11 51.05 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.998 0.428 . . . . 0.0 110.448 -176.571 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.829 HG23 HG13 ' A' ' 93' ' ' ILE . 30.7 m -136.82 137.17 39.48 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.504 -178.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.563 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 62.9 ttt180 -96.95 111.83 23.86 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.345 -0.389 . . . . 0.0 109.953 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -109.79 138.32 46.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.103 0.477 . . . . 0.0 111.308 -179.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.532 ' HB2' ' CG ' ' A' ' 89' ' ' ARG . 6.5 m -112.31 132.71 54.82 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 172.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.577 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.7 pp -137.77 144.29 31.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 110.541 -0.17 . . . . 0.0 110.541 -176.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.675 HD11 HG11 ' A' ' 22' ' ' VAL . 6.1 pt -140.43 146.95 23.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 174.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -97.66 126.57 43.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.898 0.38 . . . . 0.0 110.828 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.717 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 12.9 p -103.03 140.37 37.37 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.475 177.411 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -64.65 -32.2 73.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.783 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.419 HG22 ' H ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -150.9 171.71 16.82 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.54 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.665 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 33.8 tt0 -62.2 -36.25 81.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.246 0.546 . . . . 0.0 109.633 -179.116 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -53.89 -40.31 66.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.667 177.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.717 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 8.6 mm-40 -69.14 -41.2 77.62 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.776 -179.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.556 ' HA ' HG21 ' A' ' 13' ' ' THR . . . -59.18 -44.85 92.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.327 177.406 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.665 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.3 mmtp -55.89 -48.0 76.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.291 176.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.06 -33.07 73.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.108 0.48 . . . . 0.0 110.972 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.675 HG11 HD11 ' A' ' 11' ' ' ILE . 79.4 t -73.73 -50.37 29.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.25 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.8 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -68.17 -30.53 69.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.138 -176.06 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.477 ' O ' ' HB2' ' A' ' 27' ' ' ASN . 12.8 t70 -64.3 -41.23 96.97 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.1 0.476 . . . . 0.0 110.235 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -76.07 -39.07 56.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.186 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.813 HD13 ' HB3' ' A' ' 75' ' ' LEU . 4.1 pp -71.87 -13.87 61.79 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.159 177.45 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 1.9 m-20 -62.91 -33.14 74.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.987 172.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -71.92 -29.75 64.63 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 121.605 0.717 . . . . 0.0 109.371 172.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.75 29.7 46.72 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.03 -0.987 . . . . 0.0 112.334 178.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.84 -63.2 1.28 Allowed Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 119.377 -1.392 . . . . 0.0 113.326 -175.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.408 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 9.4 t0 -139.28 115.72 10.55 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 117.241 0.521 . . . . 0.0 111.86 178.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.456 ' HA ' HD12 ' A' ' 35' ' ' LEU . 73.3 t80 -84.89 -41.07 16.32 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.791 0.329 . . . . 0.0 110.816 172.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.43 -33.47 65.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.111 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.79 -44.52 85.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.091 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.456 HD12 ' HA ' ' A' ' 32' ' ' PHE . 12.9 mt -62.54 -37.26 85.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.395 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.549 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -62.52 -48.28 80.23 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.351 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.691 ' HA ' HG22 ' A' ' 43' ' ' ILE . 54.8 mtpt -79.1 -33.86 44.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.124 -173.284 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -79.81 -55.68 4.81 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -177.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.842 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -97.85 -24.54 15.38 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.664 0.745 . . . . 0.0 112.919 -168.303 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.549 ' HB3' ' O ' ' A' ' 36' ' ' ALA . 43.2 t -89.6 152.29 21.47 Favored 'General case' 0 C--N 1.291 -1.953 0 O-C-N 121.133 -0.979 . . . . 0.0 113.008 -167.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.38 0.93 39.65 Favored 'General case' 0 C--N 1.334 -0.069 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.102 172.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.518 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 20.2 t70 -65.07 -15.99 62.97 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.501 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 1.06 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.6 pp -55.39 -16.35 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -157.634 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.472 ' N ' HD12 ' A' ' 43' ' ' ILE . 77.7 mt -51.76 -43.11 33.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.258 0.551 . . . . 0.0 109.603 167.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.9 m -109.41 -25.56 10.46 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.139 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 1.06 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -50.96 -29.0 11.05 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -174.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -53.74 -24.5 15.12 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -89.4 10.65 21.76 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.033 0.445 . . . . 0.0 110.898 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.22 22.83 31.15 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.359 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.405 ' O ' ' HA ' ' A' ' 9' ' ' SER . . . 62.21 29.19 72.26 Favored Glycine 0 C--N 1.331 0.284 0 N-CA-C 111.679 -0.568 . . . . 0.0 111.679 -178.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -90.56 113.58 25.62 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.289 0.566 . . . . 0.0 111.226 -172.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 96.7 mmm -75.51 -19.22 59.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.111 177.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 100.15 -149.11 18.64 Favored Glycine 0 N--CA 1.437 -1.253 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.641 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.646 ' CZ3' ' HG2' ' A' ' 94' ' ' GLN . 86.7 m95 -109.3 111.82 23.61 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.23 0.538 . . . . 0.0 111.212 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.498 ' O ' HD12 ' A' ' 55' ' ' LEU . 1.4 pp -99.0 153.12 19.1 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.679 174.696 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.535 ' HA ' ' HG2' ' A' ' 5' ' ' ARG . 21.7 mt-10 -90.51 140.28 29.88 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -67.39 149.56 50.12 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.121 -178.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.32 7.42 6.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.065 -175.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.8 p -112.18 3.91 17.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.717 0.77 . . . . 0.0 109.116 167.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.511 ' HB ' ' HD3' ' A' ' 65' ' ' LYS . 22.2 mt -87.13 136.17 34.12 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.049 -169.452 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.53 139.47 81.9 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.265 1.977 . . . . 0.0 110.718 171.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.61 -23.86 59.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.136 -172.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -54.01 -47.58 71.34 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.161 0.288 . . . . 0.0 110.892 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 mp -83.33 -23.15 32.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.636 0.255 . . . . 0.0 111.381 -178.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.511 ' HD3' ' HB ' ' A' ' 60' ' ' ILE . 32.1 mmmt -69.83 -37.53 76.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.009 0.433 . . . . 0.0 110.22 176.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -80.19 -5.27 55.81 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.219 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.77 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -57.69 -25.13 59.86 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.856 0.36 . . . . 0.0 111.918 -179.493 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.86 19.9 66.72 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.313 177.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.674 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 15.3 mt -95.43 94.12 7.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.186 0.517 . . . . 0.0 111.678 -175.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -101.22 -47.84 4.59 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.936 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.46 ' O ' HD13 ' A' ' 90' ' ' LEU . 35.6 mm-40 -84.74 129.75 34.78 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.078 -171.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 92' ' ' ASP . 63.3 tttm -66.31 117.66 8.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.103 0.478 . . . . 0.0 111.073 -174.036 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 102.67 -1.16 48.99 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.653 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.419 ' HB3' HD12 ' A' ' 90' ' ' LEU . 58.7 tt0 -68.54 126.63 30.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.813 ' HB3' HD13 ' A' ' 26' ' ' LEU . 62.8 mt -116.54 166.08 12.5 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.819 -174.379 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.509 ' HB2' HD11 ' A' ' 26' ' ' LEU . 12.5 t 76.33 57.82 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.877 0.846 . . . . 0.0 111.106 168.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.443 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -102.4 103.84 2.51 Favored Glycine 0 N--CA 1.439 -1.14 0 N-CA-C 110.146 -1.182 . . . . 0.0 110.146 169.433 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 26.3 t -98.97 113.06 32.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.152 0.501 . . . . 0.0 109.77 -175.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.443 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 79.2 mt -102.29 116.97 46.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.86 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -86.76 127.11 34.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.357 0.599 . . . . 0.0 111.471 -177.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.5 m -128.91 155.2 45.66 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.014 174.02 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.4 m -59.84 -27.15 66.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.949 0.404 . . . . 0.0 111.424 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 10.0 p -87.23 -17.82 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.477 -177.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 158.86 -171.19 35.45 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.964 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -112.06 140.67 46.55 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.754 0.311 . . . . 0.0 110.904 -176.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.472 HD11 ' HB ' ' A' ' 10' ' ' ILE . 34.1 tp -113.24 135.76 53.48 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.412 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.614 ' HB ' HG12 ' A' ' 11' ' ' ILE . 24.2 mm -104.7 130.69 55.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 177.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.77 HG11 ' HB1' ' A' ' 67' ' ' ALA . 13.6 p -125.18 140.76 47.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -177.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.692 ' NH2' ' HA ' ' A' ' 91' ' ' ASP . 0.2 OUTLIER -142.14 158.7 43.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.327 0.584 . . . . 0.0 110.862 177.023 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.959 HD22 HD11 ' A' ' 93' ' ' ILE . 10.8 mt -99.95 108.86 21.18 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.479 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.692 ' HA ' ' NH2' ' A' ' 89' ' ' ARG . 19.0 t70 -81.07 -54.08 5.85 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.322 -0.551 . . . . 0.0 111.826 177.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.622 ' HA ' ' HE2' ' A' ' 72' ' ' LYS . 9.1 t70 -155.98 152.99 28.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.458 -177.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.959 HD11 HD22 ' A' ' 90' ' ' LEU . 4.7 mp -133.1 128.32 55.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.022 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.646 ' HG2' ' CZ3' ' A' ' 54' ' ' TRP . 25.4 pt20 -132.21 129.28 39.49 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.264 0.555 . . . . 0.0 110.993 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.02 45.42 1.17 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.583 177.147 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.428 ' HB1' ' HG2' ' A' ' 2' ' ' GLN . . . 63.23 -162.27 0.28 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.212 -0.903 . . . . 0.0 111.601 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 15.3 m-70 -94.31 -99.71 0.15 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 41.5 t60 62.35 -72.7 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.715 0.806 . . . . 0.0 111.647 179.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.432 ' H ' ' H ' ' A' ' 100' ' ' HIS . 38.0 t60 -153.96 -14.53 0.14 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.011 0.434 . . . . 0.0 109.886 178.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 0.432 ' H ' ' H ' ' A' ' 99' ' ' HIS . 63.1 m80 -77.72 149.35 34.58 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.995 -177.696 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -75.82 97.07 3.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.194 0.521 . . . . 0.0 110.4 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 51.2 p-80 . . . . . 0 C--O 1.248 0.987 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.067 178.406 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 31.5 m . . . . . 0 N--CA 1.476 0.852 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.456 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 76.4 mt-30 -71.58 124.83 91.54 Favored Pre-proline 0 CA--C 1.515 -0.37 0 CA-C-O 121.128 0.49 . . . . 0.0 111.331 -178.183 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 2' ' ' GLN . 93.9 Cg_endo -92.3 150.08 3.04 Favored 'Trans proline' 0 N--CA 1.446 -1.291 0 C-N-CA 123.791 2.994 . . . . 0.0 110.509 175.115 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.637 ' HB2' ' HB2' ' A' ' 96' ' ' ALA . 10.1 pt20 -71.12 148.89 46.98 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.602 ' HG3' ' HB2' ' A' ' 94' ' ' GLN . 25.0 ptt180 -122.35 129.8 52.48 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.355 0.598 . . . . 0.0 109.9 176.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.557 HG23 HG23 ' A' ' 93' ' ' ILE . 20.6 m -120.27 141.39 50.03 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.056 -0.975 . . . . 0.0 109.987 -174.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.634 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 66.0 ttt180 -95.02 111.0 22.85 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 120.071 -0.652 . . . . 0.0 109.249 177.034 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.408 ' HE2' HD13 ' A' ' 60' ' ' ILE . 15.2 m-85 -106.91 135.08 49.07 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.381 0.61 . . . . 0.0 111.239 -178.208 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.579 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 20.4 m -112.36 134.82 53.69 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.272 -0.876 . . . . 0.0 108.846 169.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.643 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.8 pp -139.59 143.06 31.46 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -177.125 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.732 ' HA ' ' HB2' ' A' ' 42' ' ' ASP . 1.1 pt -138.04 141.76 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -96.8 117.35 30.89 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -179.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.646 HG22 ' HE3' ' A' ' 39' ' ' LYS . 2.5 p -94.36 147.88 22.78 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.384 0.612 . . . . 0.0 110.916 -175.582 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.624 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 10.8 mmmm -64.77 -33.85 76.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.649 -171.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.491 HG22 ' H ' ' A' ' 16' ' ' GLU . 10.4 m -157.36 171.16 20.89 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.491 ' H ' HG22 ' A' ' 15' ' ' THR . 29.5 tt0 -57.63 -35.4 70.44 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.248 0.547 . . . . 0.0 110.323 -179.205 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -54.0 -43.11 69.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.497 176.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.624 ' HG3' ' HB2' ' A' ' 14' ' ' LYS . 8.1 mm-40 -64.32 -42.4 96.34 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.39 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.506 ' CB ' HD11 ' A' ' 87' ' ' ILE . . . -62.07 -46.39 89.35 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.975 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.641 ' HD3' HD21 ' A' ' 23' ' ' LEU . 30.0 mmtp -60.43 -39.67 88.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.971 178.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.19 -31.57 72.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.008 0.432 . . . . 0.0 110.871 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 18' ' ' GLU . 81.4 t -72.92 -50.58 31.69 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.865 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.641 HD21 ' HD3' ' A' ' 20' ' ' LYS . 4.2 pp -65.72 -27.64 68.47 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.336 -176.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.417 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.7 t70 -64.1 -53.52 48.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.003 0.43 . . . . 0.0 110.302 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.467 ' HG2' HD21 ' A' ' 35' ' ' LEU . 1.5 tp10 -66.37 -41.4 89.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.976 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.92 HD11 ' HB2' ' A' ' 76' ' ' SER . 3.8 pp -73.08 -16.67 61.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.012 -179.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.434 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -71.38 -30.68 66.41 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 175.129 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -76.02 -32.6 59.46 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 169.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 80.62 36.37 23.14 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.518 -1.219 . . . . 0.0 113.749 168.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -85.38 -63.73 1.55 Allowed Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 118.871 -1.633 . . . . 0.0 112.404 -178.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -139.95 121.23 14.92 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.824 0.312 . . . . 0.0 110.93 173.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -84.51 -32.06 24.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.095 0.474 . . . . 0.0 110.3 174.285 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.65 -35.98 71.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.087 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.32 -36.22 78.98 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.353 0.597 . . . . 0.0 110.289 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.467 HD21 ' HG2' ' A' ' 25' ' ' GLU . 6.6 mt -69.56 -32.92 71.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.242 -178.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.545 ' HB2' HG21 ' A' ' 11' ' ' ILE . . . -71.23 -46.2 61.6 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.562 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.7 mtpt -77.76 -28.75 50.68 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -168.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -79.34 -61.8 1.89 Allowed 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -169.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.646 ' HE3' HG22 ' A' ' 13' ' ' THR . 0.0 OUTLIER -104.16 -21.99 13.47 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 -179.903 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.524 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 10.4 m -75.21 143.73 43.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.205 0.526 . . . . 0.0 111.53 -168.243 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -76.84 5.84 7.13 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.778 -177.897 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.732 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 18.9 t70 -64.03 -16.26 61.27 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.243 -1.344 . . . . 0.0 111.767 176.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.963 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.6 pp -55.83 -15.51 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 -159.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.43 ' N ' HD12 ' A' ' 43' ' ' ILE . 66.5 mt -58.11 -44.14 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-O 121.096 0.474 . . . . 0.0 109.849 167.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -109.65 -13.84 14.45 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.931 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.963 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -53.3 -29.07 31.46 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 122.765 0.426 . . . . 0.0 111.777 178.275 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -55.08 -19.4 7.23 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.513 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.9 m-20 -89.96 0.22 57.21 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.84 0.352 . . . . 0.0 110.614 177.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.47 29.31 14.37 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.131 -0.787 . . . . 0.0 111.131 -173.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.545 ' HA2' ' OD2' ' A' ' 42' ' ' ASP . . . 80.36 -2.64 76.38 Favored Glycine 0 N--CA 1.453 -0.222 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -175.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -73.86 122.23 22.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.101 0.477 . . . . 0.0 111.846 -175.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.487 ' SD ' HG12 ' A' ' 10' ' ' ILE . 87.6 mtp -78.1 -34.46 50.13 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.149 172.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 120.15 -172.14 14.8 Favored Glycine 0 N--CA 1.438 -1.19 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.186 -174.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.531 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 94.6 m95 -89.68 120.71 31.19 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 120.824 0.345 . . . . 0.0 111.078 178.525 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.521 HD23 ' O ' ' A' ' 55' ' ' LEU . 0.6 OUTLIER -115.7 155.37 27.85 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 174.644 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -88.5 139.57 30.34 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 120.967 0.413 . . . . 0.0 109.924 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.414 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 27.9 t0 -56.96 151.32 15.02 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.337 173.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.414 ' HB3' ' O ' ' A' ' 57' ' ' ASP . . . 72.5 7.11 5.58 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 124.319 1.012 . . . . 0.0 110.943 -172.074 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.2 m -111.53 -0.25 16.23 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 162.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.708 ' HB ' ' HE2' ' A' ' 65' ' ' LYS . 56.6 mt -88.39 115.59 63.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.62 -176.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.26 157.66 58.87 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.166 2.577 . . . . 0.0 111.65 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.624 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . 4.7 m-20 -56.79 -20.96 25.23 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.915 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.47 -52.64 64.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.478 175.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.447 ' O ' ' HB3' ' A' ' 67' ' ' ALA . 6.3 mp -82.93 -14.23 54.54 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.929 0.395 . . . . 0.0 110.708 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.708 ' HE2' ' HB ' ' A' ' 60' ' ' ILE . 72.2 mmtt -73.3 -34.4 65.71 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 172.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 -75.15 -5.8 46.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.736 174.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.956 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -74.43 -32.25 62.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.202 175.066 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 73.8 21.55 79.17 Favored Glycine 0 C--N 1.336 0.529 0 CA-C-N 115.393 -0.821 . . . . 0.0 113.016 176.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.686 HD13 ' HG ' ' A' ' 90' ' ' LEU . 12.4 mt -86.41 94.64 9.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.071 0.463 . . . . 0.0 111.396 -177.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -100.29 -54.73 2.79 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.308 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.531 ' O ' HD13 ' A' ' 90' ' ' LEU . 36.8 mt-10 -106.92 142.88 35.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.12 0.486 . . . . 0.0 111.56 -172.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.571 ' CD ' ' HA ' ' A' ' 92' ' ' ASP . 28.0 ttpp -66.74 137.12 56.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.702 -168.588 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.1 -6.28 36.82 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.586 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.596 ' HB3' HD12 ' A' ' 90' ' ' LEU . 59.1 tt0 -91.65 116.41 28.85 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.53 0.681 . . . . 0.0 110.034 176.396 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.672 ' HG ' HD13 ' A' ' 26' ' ' LEU . 2.1 pt? -139.53 169.81 17.07 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.92 ' HB2' HD11 ' A' ' 26' ' ' LEU . 37.1 t 78.87 59.98 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 122.288 1.042 . . . . 0.0 109.877 -167.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -111.7 108.6 2.33 Favored Glycine 0 N--CA 1.439 -1.103 0 CA-C-N 114.192 -1.367 . . . . 0.0 109.79 168.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 37.4 t -92.11 113.6 27.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.0 0.429 . . . . 0.0 110.415 -173.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.563 HD11 ' HB2' ' A' ' 67' ' ' ALA . 71.3 mt -106.87 122.13 60.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.828 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 58.2 tttp -85.54 128.99 34.92 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.216 0.532 . . . . 0.0 110.794 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.2 m -118.66 161.51 19.96 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 174.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 26.2 t -69.58 -28.56 66.07 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.184 0.516 . . . . 0.0 109.707 176.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 10.7 p -84.33 -12.95 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.607 -177.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 157.94 -139.22 6.22 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.749 -0.738 . . . . 0.0 111.77 -177.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -131.16 149.38 52.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 117.048 0.424 . . . . 0.0 111.075 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.618 HD11 ' HB ' ' A' ' 10' ' ' ILE . 40.3 tp -121.41 135.46 55.06 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.15 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.643 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 28.9 mm -109.97 126.37 67.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.878 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.956 HG11 ' HB1' ' A' ' 67' ' ' ALA . 7.1 p -108.3 141.87 22.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 121.102 0.477 . . . . 0.0 110.497 -177.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.579 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 1.5 tmm_? -141.21 122.04 14.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.529 -175.326 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.686 ' HG ' HD13 ' A' ' 69' ' ' LEU . 9.8 mt -77.7 108.82 11.18 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.842 176.348 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.634 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 34.3 t70 -80.8 -54.17 5.84 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 119.32 -0.952 . . . . 0.0 111.54 175.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.571 ' HA ' ' CD ' ' A' ' 72' ' ' LYS . 2.7 t70 -156.47 170.69 21.74 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.71 -177.1 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.557 HG23 HG23 ' A' ' 6' ' ' THR . 0.4 OUTLIER -137.48 136.84 46.27 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-O 121.086 0.47 . . . . 0.0 110.976 175.827 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.602 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . 84.2 mt-30 -127.05 127.5 44.82 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.554 178.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . 70.61 20.15 5.87 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.204 176.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.637 ' HB2' ' HB2' ' A' ' 4' ' ' GLN . . . -110.97 115.89 30.26 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.752 -176.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 74.87 -44.36 0.54 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 166.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -59.32 -56.15 25.77 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -168.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 27.9 p80 -98.38 -0.25 44.05 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.652 -178.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -163.32 122.01 2.03 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.317 -0.624 . . . . 0.0 109.317 176.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 8.4 p80 -60.23 124.29 19.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.568 0.699 . . . . 0.0 110.833 -175.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 11.6 m80 . . . . . 0 C--N 1.316 -0.865 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.251 179.675 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 2.8 t . . . . . 0 N--CA 1.477 0.891 0 CA-C-O 121.348 0.594 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -117.22 146.38 38.05 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.2 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -86.07 126.15 2.78 Favored 'Trans proline' 0 N--CA 1.448 -1.182 0 C-N-CA 122.506 2.138 . . . . 0.0 110.841 175.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.467 ' HB2' ' HA ' ' A' ' 95' ' ' ALA . 30.0 pt20 -70.03 155.44 40.59 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.484 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -113.95 138.54 50.21 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 120.622 -0.431 . . . . 0.0 109.923 -175.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.699 HG23 HG13 ' A' ' 93' ' ' ILE . 10.8 m -120.75 137.77 54.34 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.335 -178.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.418 ' HB2' ' CE2' ' A' ' 54' ' ' TRP . 67.8 ttt180 -101.85 111.96 24.41 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.712 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.642 ' HD2' HD21 ' A' ' 55' ' ' LEU . 17.7 m-85 -107.03 133.45 51.66 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.673 -177.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.536 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 2.6 m -98.28 132.54 43.68 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 168.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.72 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.24 147.04 21.75 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -177.199 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.757 HD11 HG11 ' A' ' 22' ' ' VAL . 3.3 pt -138.16 142.47 35.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 C-N-CA 120.423 -0.511 . . . . 0.0 109.71 177.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -97.49 115.52 27.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.094 0.473 . . . . 0.0 110.006 -177.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.43 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 77.3 p -99.01 148.93 23.5 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.398 -177.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -69.23 -34.23 74.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.77 -174.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -152.41 174.76 13.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.998 0.427 . . . . 0.0 111.923 -178.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -65.48 -26.46 67.94 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.56 -45.21 92.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.295 177.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.576 ' OE1' ' HG3' ' A' ' 39' ' ' LYS . 81.3 mm-40 -65.78 -44.86 84.49 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.635 176.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.599 ' HA ' HD11 ' A' ' 87' ' ' ILE . . . -56.41 -48.04 77.76 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.427 -176.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.468 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 1.5 mptm? -64.21 -33.54 76.04 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.17 -41.5 70.27 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.085 0.469 . . . . 0.0 110.418 177.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.757 HG11 HD11 ' A' ' 11' ' ' ILE . 93.0 t -71.51 -49.17 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.368 -178.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.559 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.5 pp -63.01 -28.56 70.19 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.031 -176.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.47 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.1 t70 -65.88 -48.81 70.27 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.174 0.511 . . . . 0.0 109.952 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.464 ' HG2' HD21 ' A' ' 35' ' ' LEU . 6.6 tp10 -66.24 -43.98 85.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.679 -178.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.678 HD23 HG12 ' A' ' 22' ' ' VAL . 4.3 pp -73.43 -19.04 61.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.105 -178.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -75.0 -24.88 58.47 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.882 0.372 . . . . 0.0 110.45 176.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -71.92 -24.23 61.6 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 170.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.72 25.84 52.07 Favored Glycine 0 N--CA 1.443 -0.849 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.517 175.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.21 -63.6 1.25 Allowed Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 119.154 -1.498 . . . . 0.0 113.061 -176.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -140.07 114.81 9.47 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.255 0.528 . . . . 0.0 111.604 177.269 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.556 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 60.2 t80 -86.78 -41.34 14.17 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.325 0.583 . . . . 0.0 109.874 170.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.664 ' O ' ' HG2' ' A' ' 37' ' ' LYS . . . -58.61 -35.44 72.46 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.221 -176.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.04 -38.42 88.34 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.49 0.662 . . . . 0.0 110.355 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.577 ' HB3' HG13 ' A' ' 22' ' ' VAL . 11.6 mt -65.32 -36.21 83.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.301 178.031 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.66 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -67.41 -41.24 85.2 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.612 -1.176 . . . . 0.0 111.126 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.664 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 13.5 mmmm -69.62 -46.37 66.39 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.655 -173.184 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -59.35 2.75 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 -166.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.576 ' HG3' ' OE1' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -100.27 -21.87 15.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.109 -174.692 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.66 ' HB3' ' O ' ' A' ' 36' ' ' ALA . 35.4 t -69.08 146.38 52.63 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 120.839 0.352 . . . . 0.0 111.515 -171.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.41 0.1 43.62 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.837 0.827 . . . . 0.0 109.931 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.598 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 38.6 t70 -66.54 -16.07 63.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.329 -1.305 . . . . 0.0 112.428 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.987 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.8 pp -55.16 -16.61 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -150.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 65.8 mt -61.97 -39.84 85.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 118.421 0.555 . . . . 0.0 109.646 169.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m -92.2 -30.88 15.69 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.322 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.987 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -52.63 -29.53 26.63 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.335 -176.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -53.58 -30.98 44.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.044 0.449 . . . . 0.0 110.941 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -90.99 9.9 28.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.225 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.28 24.71 28.28 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.586 -177.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.462 ' HA2' ' OD2' ' A' ' 42' ' ' ASP . . . 83.86 8.44 84.28 Favored Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 -176.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -72.34 108.74 5.62 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.214 0.531 . . . . 0.0 111.39 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 54.2 mmm -82.48 -24.06 34.39 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.753 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 130.07 -160.36 22.9 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.036 -175.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.652 ' CH2' ' HG2' ' A' ' 94' ' ' GLN . 81.0 m95 -107.72 138.52 43.8 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.886 0.374 . . . . 0.0 110.993 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.642 HD21 ' HD2' ' A' ' 8' ' ' TYR . 3.5 pp -126.24 156.18 40.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.208 176.053 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -82.2 130.51 35.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.077 0.465 . . . . 0.0 110.455 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -70.29 147.05 50.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.165 178.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 71.65 7.24 5.91 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 124.34 1.025 . . . . 0.0 111.788 -176.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.1 p -111.7 2.1 17.04 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 166.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.596 ' HB ' ' HE3' ' A' ' 65' ' ' LYS . 45.6 mt -69.72 128.46 91.97 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 114.215 -1.357 . . . . 0.0 111.257 -173.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.98 157.01 61.57 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 122.833 2.356 . . . . 0.0 111.445 174.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.525 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . 7.4 p-10 -56.68 -21.37 27.19 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.601 -172.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.728 ' HG3' HG21 ' A' ' 79' ' ' ILE . 39.4 tt0 -56.29 -56.59 19.22 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.087 0.242 . . . . 0.0 110.614 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.406 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 4.8 mp -83.72 -16.62 44.2 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.504 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.596 ' HE3' ' HB ' ' A' ' 60' ' ' ILE . 31.8 mmtp -60.13 -35.29 74.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.217 0.532 . . . . 0.0 110.435 174.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -78.3 -5.82 53.22 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.772 -178.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.79 -32.24 46.31 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.195 0.521 . . . . 0.0 110.419 177.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 68.98 22.09 75.67 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.326 -0.852 . . . . 0.0 113.339 176.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.709 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 6.6 mt -86.81 88.49 7.69 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.004 0.43 . . . . 0.0 111.707 -174.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.421 ' HA ' ' HD2' ' A' ' 70' ' ' LYS . 23.1 tptp -100.58 -39.98 7.63 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 178.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -95.94 128.35 42.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.955 -174.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.635 ' HB2' HD13 ' A' ' 93' ' ' ILE . 82.6 tttt -66.58 134.73 52.95 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.151 0.501 . . . . 0.0 111.044 -172.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.13 -1.63 35.28 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.538 -177.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -92.16 130.77 37.8 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.166 0.507 . . . . 0.0 110.554 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.533 ' HB3' HD13 ' A' ' 26' ' ' LEU . 2.1 mp -118.82 169.77 9.57 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.691 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.2 t 78.98 60.95 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.797 0.808 . . . . 0.0 112.593 169.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -109.21 102.84 1.7 Allowed Glycine 0 N--CA 1.443 -0.849 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 163.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.406 HG21 HD23 ' A' ' 23' ' ' LEU . 19.9 t -100.46 113.88 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.482 0 CA-C-O 121.004 0.43 . . . . 0.0 110.007 -177.317 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.728 HG21 ' HG3' ' A' ' 63' ' ' GLU . 51.5 mm -109.62 127.01 66.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.7 -177.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -77.6 125.31 29.14 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.379 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.0 m -119.9 163.79 17.02 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.029 178.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.2 m -68.91 -26.4 65.07 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.25 0.548 . . . . 0.0 110.262 177.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 14.7 p -84.1 -12.54 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.238 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.7 -133.06 4.14 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.007 -0.616 . . . . 0.0 111.786 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -130.1 139.41 50.94 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.658 0.265 . . . . 0.0 110.511 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.72 HD11 ' HB ' ' A' ' 10' ' ' ILE . 29.9 tp -120.48 135.67 54.99 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -178.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.599 HD11 ' HA ' ' A' ' 19' ' ' ALA . 5.0 mt -119.23 125.88 74.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.541 HG23 HD12 ' A' ' 69' ' ' LEU . 1.8 m -113.16 145.9 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-O 121.486 0.66 . . . . 0.0 111.311 -174.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.556 ' HD3' ' CG ' ' A' ' 32' ' ' PHE . 34.3 ttp180 -134.58 145.86 49.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.196 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.864 HD22 HD11 ' A' ' 93' ' ' ILE . 14.6 mt -87.42 108.29 18.94 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.079 0.466 . . . . 0.0 111.284 179.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.482 ' O ' ' HE3' ' A' ' 72' ' ' LYS . 3.7 t0 -80.92 -53.76 6.17 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.897 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.409 ' C ' HD12 ' A' ' 93' ' ' ILE . 10.8 m-20 -154.51 160.36 41.51 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.113 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.864 HD11 HD22 ' A' ' 90' ' ' LEU . 3.4 mp -136.05 127.69 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 172.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.652 ' HG2' ' CH2' ' A' ' 54' ' ' TRP . 81.6 mm-40 -128.23 120.02 26.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.768 0.318 . . . . 0.0 110.36 177.743 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.467 ' HA ' ' HB2' ' A' ' 4' ' ' GLN . . . -86.9 51.87 2.36 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.033 -179.311 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 56.08 85.06 0.08 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.188 -178.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 81.4 m-70 69.21 -142.98 0.09 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.657 -174.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 74.49 -47.17 0.63 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.974 0.909 . . . . 0.0 110.862 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -97.86 131.41 44.37 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 170.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 25.1 t-80 -76.58 71.95 3.22 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.991 0.424 . . . . 0.0 111.89 -171.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -161.12 24.28 0.13 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 172.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.095 -0.955 . . . . 0.0 109.83 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 56.0 p . . . . . 0 N--CA 1.477 0.907 0 CA-C-O 120.68 0.276 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLN . . . . . 0.431 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 79.8 mt-30 -72.92 124.37 90.64 Favored Pre-proline 0 N--CA 1.451 -0.399 0 CA-C-O 121.469 0.652 . . . . 0.0 111.443 -178.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 2' ' ' GLN . 92.3 Cg_endo -91.66 109.61 0.29 Allowed 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 123.557 2.838 . . . . 0.0 111.73 177.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.652 ' HB2' ' HB2' ' A' ' 96' ' ' ALA . 15.6 pt20 -70.81 158.12 36.9 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 176.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -121.99 135.0 54.81 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 120.033 -0.667 . . . . 0.0 110.389 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.731 HG23 HG13 ' A' ' 93' ' ' ILE . 22.3 m -128.67 133.59 48.26 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.311 -177.266 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.633 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 34.1 ttt180 -95.44 111.47 23.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.646 ' HD2' HD21 ' A' ' 55' ' ' LEU . 14.7 m-85 -103.96 135.4 45.55 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.283 -178.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.669 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 0.7 OUTLIER -96.33 132.18 42.09 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 168.588 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.87 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.7 141.38 27.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.628 HG12 ' HB ' ' A' ' 87' ' ' ILE . 5.6 pt -140.49 149.15 21.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.228 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -103.27 113.32 26.72 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.496 -174.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.81 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 16.1 p -94.66 141.83 28.16 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.261 178.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -64.55 -30.78 71.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.782 -174.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.31 173.67 14.21 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.511 ' HG2' ' HE2' ' A' ' 20' ' ' LYS . 32.2 tt0 -64.13 -36.58 84.5 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -53.05 -39.54 63.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.979 177.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.81 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 6.1 mm-40 -67.38 -37.1 82.61 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.776 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.83 -39.52 94.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.088 179.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.511 ' HE2' ' HG2' ' A' ' 16' ' ' GLU . 5.1 mptp? -55.55 -48.41 74.78 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.098 176.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.13 -31.05 72.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.961 0.41 . . . . 0.0 111.126 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.513 HG11 HD11 ' A' ' 11' ' ' ILE . 94.4 t -75.68 -51.91 19.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.074 179.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.459 HD12 ' N ' ' A' ' 24' ' ' ASP . 4.6 pp -66.64 -27.78 67.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.252 -176.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.459 ' N ' HD12 ' A' ' 23' ' ' LEU . 28.1 t70 -64.26 -46.72 82.49 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.759 0.314 . . . . 0.0 111.209 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.456 ' HB3' HD21 ' A' ' 35' ' ' LEU . 29.9 tt0 -75.35 -40.15 58.5 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.29 -176.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 75' ' ' LEU . 2.8 pp -69.96 -13.66 62.34 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.661 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.452 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -69.5 -21.03 63.71 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.95 174.551 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -88.99 -26.19 21.62 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 169.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.74 33.93 26.17 Favored Glycine 0 N--CA 1.449 -0.496 0 CA-C-N 114.609 -1.178 . . . . 0.0 113.397 170.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.67 -63.41 1.48 Allowed Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 119.025 -1.559 . . . . 0.0 112.839 -176.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.521 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 3.0 m-20 -139.48 116.65 11.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.883 0.342 . . . . 0.0 111.613 177.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.526 ' HA ' HD12 ' A' ' 35' ' ' LEU . 43.3 t80 -81.71 -37.87 26.66 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 169.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.49 -37.72 65.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.834 176.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.72 -39.13 84.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.581 -178.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.526 HD12 ' HA ' ' A' ' 32' ' ' PHE . 11.4 mt -66.99 -43.04 83.99 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.196 177.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . 0.428 ' CB ' HG21 ' A' ' 11' ' ' ILE . . . -59.28 -53.29 59.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.394 -1.276 . . . . 0.0 111.892 -177.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.497 ' HA ' HG22 ' A' ' 43' ' ' ILE . 40.2 mtpt -75.66 -29.5 59.1 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.906 -169.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -79.92 -56.03 4.55 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.813 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 1.2 tppp? -97.66 -24.74 15.37 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -163.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.625 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 24.7 p -92.17 156.56 17.25 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.024 -1.048 . . . . 0.0 112.387 -165.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.98 6.07 19.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.335 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.466 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 13.1 t70 -75.27 -15.24 60.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.051 -0.977 . . . . 0.0 112.218 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 1.033 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.7 pp -55.8 -15.98 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -152.186 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.477 ' N ' HD12 ' A' ' 43' ' ' ILE . 58.3 mt -53.93 -37.56 34.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 118.427 0.558 . . . . 0.0 109.748 169.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 p -107.72 -25.09 11.45 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.483 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 1.033 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -56.65 -29.21 62.01 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 178.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 43' ' ' ILE . 99.2 mtt180 -57.87 -15.84 9.88 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.866 0.365 . . . . 0.0 111.524 176.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -89.65 10.73 22.08 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.654 0.74 . . . . 0.0 109.866 176.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.54 10.19 62.17 Favored Glycine 0 N--CA 1.453 -0.187 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.074 -177.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.431 ' HA2' ' HA ' ' A' ' 46' ' ' ALA . . . 96.57 -13.5 65.36 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.109 177.315 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASP . . . . . 0.539 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 47.6 m-20 -72.95 114.4 11.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.504 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 27.0 ptm -71.93 -21.81 61.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.899 -177.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 132.23 -159.62 23.4 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.86 -179.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.432 ' CH2' ' HG3' ' A' ' 94' ' ' GLN . 86.1 m95 -109.04 117.02 33.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.82 0.343 . . . . 0.0 110.633 -179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.646 HD21 ' HD2' ' A' ' 8' ' ' TYR . 2.0 pp -103.66 151.81 22.53 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.79 174.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -92.39 136.77 32.92 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.103 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -57.04 147.99 22.8 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.144 177.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.73 6.99 6.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.263 -0.881 . . . . 0.0 112.383 -178.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 p -111.81 7.45 20.18 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 163.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.646 ' HB ' ' HE3' ' A' ' 65' ' ' LYS . 36.1 mt -86.24 127.25 62.17 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.633 -174.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -65.91 151.74 83.31 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.445 2.096 . . . . 0.0 111.396 174.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.412 ' HA ' ' CG ' ' A' ' 65' ' ' LYS . 5.2 p-10 -59.34 -17.88 33.42 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.349 -176.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -64.04 -47.28 80.81 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.778 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.8 mp -83.4 -15.06 51.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.825 0.345 . . . . 0.0 110.659 177.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.646 ' HE3' ' HB ' ' A' ' 60' ' ' ILE . 33.2 mmtp -63.34 -30.51 71.63 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.487 0.66 . . . . 0.0 109.764 173.37 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -74.0 -11.52 60.36 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.263 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.551 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -70.49 -31.35 68.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.1 0.476 . . . . 0.0 111.151 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.47 19.3 64.43 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.751 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.713 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 18.6 mt -85.34 90.9 8.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.048 0.451 . . . . 0.0 111.142 -176.024 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -100.41 -43.49 6.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.66 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -107.64 135.31 49.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.764 0.316 . . . . 0.0 110.905 -174.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.605 ' HD3' ' HA ' ' A' ' 92' ' ' ASP . 6.7 ttpm? -66.58 138.97 57.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.767 -171.426 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.39 -5.19 35.42 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -94.19 128.49 40.66 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.231 0.538 . . . . 0.0 110.035 177.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 26' ' ' LEU . 1.2 pp -145.14 170.91 15.31 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.902 -175.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.62 ' HB2' ' CD1' ' A' ' 26' ' ' LEU . 25.6 t 79.25 49.71 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.425 1.078 . . . . 0.0 110.809 -174.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.421 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -98.72 110.73 4.07 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 168.05 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.29 113.36 39.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -176.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.562 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 47.5 mm -97.0 114.84 34.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.478 -175.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.773 ' HG2' ' CE2' ' A' ' 85' ' ' PHE . 2.4 tmtp? -83.62 113.92 21.18 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.166 -174.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.7 m -122.93 167.41 13.61 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.134 176.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.5 t -84.59 -26.32 28.02 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 32.9 m -77.78 -10.45 13.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.241 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 149.24 -159.38 28.03 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.416 -0.674 . . . . 0.0 111.416 -179.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' PHE . . . . . 0.773 ' CE2' ' HG2' ' A' ' 80' ' ' LYS . 91.1 m-85 -125.66 132.5 52.42 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.848 0.356 . . . . 0.0 110.513 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.87 HD11 ' HB ' ' A' ' 10' ' ' ILE . 41.6 tp -107.19 135.37 48.84 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.147 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.663 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 22.4 mm -108.1 124.14 64.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.581 HG22 HD12 ' A' ' 69' ' ' LEU . 12.1 p -113.51 139.5 38.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.355 0.597 . . . . 0.0 111.232 -175.094 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.669 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 7.5 ttp180 -136.49 148.0 47.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.815 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.713 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.9 mt -94.72 109.42 21.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.619 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.633 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 37.1 t70 -80.46 -55.05 5.15 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 119.942 -0.703 . . . . 0.0 111.58 175.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.605 ' HA ' ' HD3' ' A' ' 72' ' ' LYS . 35.9 t70 -157.13 160.21 38.59 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.62 0.248 . . . . 0.0 111.232 177.59 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.731 HG13 HG23 ' A' ' 6' ' ' THR . 3.8 mp -124.73 127.1 72.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 172.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.432 ' HG3' ' CH2' ' A' ' 54' ' ' TRP . 82.3 mt-30 -115.94 156.36 26.36 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -176.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . 72.83 -53.29 0.7 Allowed 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.025 -0.988 . . . . 0.0 112.551 176.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.652 ' HB2' ' HB2' ' A' ' 4' ' ' GLN . . . -57.34 -49.28 76.65 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.158 -174.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' HIS . . . . . 0.401 ' HA ' ' H ' ' A' ' 102' ' ' HIS . 33.5 t-80 -80.51 -20.27 43.96 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.009 -172.479 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -93.7 -27.21 16.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.527 -175.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -65.94 -69.5 0.3 Allowed 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 121.025 -0.27 . . . . 0.0 111.662 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -135.84 39.24 2.79 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.986 -0.285 . . . . 0.0 111.447 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 47.7 m170 54.4 75.85 0.27 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.475 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.401 ' H ' ' HA ' ' A' ' 97' ' ' HIS . 11.2 m-70 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.301 -0.857 . . . . 0.0 109.713 170.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo . . . . . 0 N--CA 1.46 -0.471 0 CA-C-O 121.429 0.512 . . . . 0.0 113.429 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.492 ' HG3' ' HB2' ' A' ' 57' ' ' ASP . 13.1 pt20 -70.74 160.15 33.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.323 172.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.483 ' HB2' ' CG ' ' A' ' 94' ' ' GLN . 99.3 mtt180 -122.59 151.18 41.68 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.995 0.426 . . . . 0.0 111.024 -177.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.659 HG23 HD13 ' A' ' 93' ' ' ILE . 32.2 m -135.19 136.04 41.49 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.516 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.632 ' HD3' ' OD1' ' A' ' 91' ' ' ASP . 63.3 ttt180 -100.84 111.39 23.6 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.793 ' HD2' HD21 ' A' ' 55' ' ' LEU . 19.5 m-85 -106.84 141.06 38.67 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.742 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.498 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 14.7 m -112.84 131.95 55.49 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 169.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.615 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.7 pp -142.59 141.58 27.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 N-CA-C 110.369 -0.234 . . . . 0.0 110.369 -173.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.706 HD11 HG11 ' A' ' 22' ' ' VAL . 10.5 pt -140.42 144.87 26.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -103.37 128.97 50.33 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.924 0.392 . . . . 0.0 110.743 -176.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.725 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 10.9 p -109.0 156.21 20.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.186 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.502 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 71.9 mmtt -65.62 -49.1 69.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.379 -179.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.99 175.61 9.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.557 -177.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.684 ' HG2' ' HD3' ' A' ' 20' ' ' LYS . 26.7 tt0 -63.4 -31.32 72.44 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 176.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -56.62 -45.66 81.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.363 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.725 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 8.4 mm-40 -65.5 -43.01 91.49 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.97 179.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.82 -47.43 85.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.915 178.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.684 ' HD3' ' HG2' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -56.63 -40.85 76.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 175.639 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.92 -37.55 87.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.125 0.488 . . . . 0.0 110.689 177.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.706 HG11 HD11 ' A' ' 11' ' ' ILE . 73.5 t -71.59 -48.23 53.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.371 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.715 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -70.74 -27.85 64.27 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.324 -176.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -61.79 -43.61 98.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.079 0.466 . . . . 0.0 110.16 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.447 ' HG2' HD21 ' A' ' 35' ' ' LEU . 7.5 tp10 -69.66 -46.2 66.68 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.642 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.842 HD13 HD13 ' A' ' 75' ' ' LEU . 3.5 pp -73.0 -13.91 61.32 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.457 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.422 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -66.65 -28.2 68.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.188 0.518 . . . . 0.0 110.125 175.517 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -74.92 -32.19 61.73 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 170.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.14 36.11 13.64 Favored Glycine 0 N--CA 1.444 -0.776 0 CA-C-N 114.555 -1.202 . . . . 0.0 113.24 171.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.79 -64.16 1.26 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 118.877 -1.63 . . . . 0.0 112.741 -178.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -140.31 122.6 15.91 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.904 174.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.619 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 59.3 t80 -84.5 -38.13 20.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.008 0.432 . . . . 0.0 110.232 171.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.58 -38.41 66.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.838 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.49 ' O ' ' HG3' ' A' ' 38' ' ' GLU . . . -64.75 -42.85 94.84 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.504 0.669 . . . . 0.0 110.418 -178.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.447 HD21 ' HG2' ' A' ' 25' ' ' GLU . 9.8 mt -64.07 -36.44 84.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.448 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.595 ' HA ' HG21 ' A' ' 11' ' ' ILE . . . -63.29 -43.85 96.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.309 -1.314 . . . . 0.0 112.174 -176.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.404 ' HG3' ' HA ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -77.5 -30.17 52.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.945 -173.772 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 43.6 mt-10 -79.39 -57.81 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -170.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.589 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -99.32 -26.44 14.16 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.655 0.74 . . . . 0.0 112.276 -171.266 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.578 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 37.1 t -67.65 137.56 55.68 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -170.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.25 1.03 38.61 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.662 171.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.461 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 24.9 t70 -69.85 -14.87 62.96 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.952 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 1.05 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.3 pp -54.6 -14.72 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -155.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.889 ' H ' HD12 ' A' ' 44' ' ' ILE . 3.6 mp -51.18 -37.9 18.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 167.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.8 m -109.92 -32.93 6.87 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.816 174.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 1.05 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -54.58 -29.26 50.95 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.547 ' HG3' ' O ' ' A' ' 43' ' ' ILE . 80.4 mtp180 -59.34 -15.1 14.24 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 117.718 0.236 . . . . 0.0 111.44 178.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -83.69 9.64 11.2 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.974 0.416 . . . . 0.0 110.536 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.1 26.17 22.35 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 111.605 -0.598 . . . . 0.0 111.605 -176.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 83.64 -8.06 66.97 Favored Glycine 0 C--N 1.329 0.181 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -73.26 116.22 13.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.889 0.376 . . . . 0.0 111.184 -177.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.584 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 26.0 ptm -82.24 -19.38 39.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.697 176.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 118.24 177.0 17.0 Favored Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.957 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.568 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 72.2 m95 -84.37 114.68 22.05 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.682 0.277 . . . . 0.0 110.781 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.793 HD21 ' HD2' ' A' ' 8' ' ' TYR . 3.1 pp -98.01 155.72 16.97 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.594 175.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.43 ' HG2' ' HG2' ' A' ' 5' ' ' ARG . 35.5 mt-10 -96.63 145.33 25.85 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.492 ' HB2' ' HG3' ' A' ' 4' ' ' GLN . 13.8 t70 -65.13 141.2 58.78 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -176.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 72.14 9.22 5.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.335 -177.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 15.8 p -110.45 -0.1 17.6 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 167.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.715 HG12 HD13 ' A' ' 55' ' ' LEU . 25.0 mt -71.55 129.87 88.09 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.945 -176.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.446 ' HG2' HD13 ' A' ' 64' ' ' LEU . 30.1 Cg_endo -65.03 148.89 89.82 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.487 2.125 . . . . 0.0 111.169 173.042 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.678 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 0.8 OUTLIER -56.43 -25.24 49.75 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.462 -175.121 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.21 -49.74 75.05 Favored 'General case' 0 C--N 1.319 -0.743 0 O-C-N 123.41 0.444 . . . . 0.0 110.51 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.446 HD13 ' HG2' ' A' ' 61' ' ' PRO . 6.0 mp -83.42 -15.29 50.27 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.678 ' HD2' ' HA ' ' A' ' 62' ' ' ASP . 97.3 mttt -61.48 -31.97 71.97 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.449 0.642 . . . . 0.0 109.879 174.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -83.53 -5.37 59.15 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.6 -178.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.759 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -69.08 -32.01 71.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.007 0.432 . . . . 0.0 111.598 -178.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 70.19 17.7 74.23 Favored Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.477 174.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.709 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 15.3 mt -91.68 84.49 5.46 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -176.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.459 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 40.4 mmtm -102.73 -22.77 13.88 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 174.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -94.07 120.24 34.05 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.475 0.178 . . . . 0.0 111.157 -178.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.6 tttp -66.42 130.15 42.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.039 0.447 . . . . 0.0 111.452 -171.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.27 -12.49 40.19 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 111.224 -0.751 . . . . 0.0 111.224 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -78.23 122.29 25.5 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.106 0.479 . . . . 0.0 110.227 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.842 HD13 HD13 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -133.01 169.59 16.61 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.525 -179.673 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.697 ' HB2' HD11 ' A' ' 26' ' ' LEU . 23.1 t 77.99 53.24 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 124.178 0.924 . . . . 0.0 110.297 -174.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -101.11 108.77 3.5 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 110.227 -1.149 . . . . 0.0 110.227 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.2 t -99.17 113.72 34.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.144 0.497 . . . . 0.0 109.972 -176.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.472 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 69.2 mt -98.93 115.29 39.09 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.071 -178.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.576 ' HG2' ' HE2' ' A' ' 85' ' ' PHE . 1.5 tmtp? -81.19 113.66 19.49 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.905 -175.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.0 t -125.78 160.84 28.76 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 12.2 t -74.4 -26.28 59.99 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.156 0.503 . . . . 0.0 109.893 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 25.8 m -79.65 -10.12 12.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.988 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.16 -163.99 27.32 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 111.099 -0.8 . . . . 0.0 111.099 -178.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.576 ' HE2' ' HG2' ' A' ' 80' ' ' LYS . 96.7 m-85 -116.39 129.53 56.29 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.061 0.458 . . . . 0.0 110.892 -176.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.602 HD11 ' HB ' ' A' ' 10' ' ' ILE . 48.4 tp -103.93 135.06 46.16 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.875 -178.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.615 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 22.4 mm -107.64 121.4 60.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.759 HG11 ' HB1' ' A' ' 67' ' ' ALA . 14.8 p -110.5 137.48 42.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 CA-C-O 121.206 0.527 . . . . 0.0 111.024 -176.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.778 ' HG3' ' HB3' ' A' ' 75' ' ' LEU . 7.0 ttp180 -132.14 144.61 50.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.975 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.709 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 10.6 mt -93.22 110.47 21.98 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.359 177.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.632 ' OD1' ' HD3' ' A' ' 7' ' ' ARG . 17.5 t70 -79.06 -54.33 6.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.812 177.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.568 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 6.5 t70 -156.17 165.91 35.0 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.713 0.292 . . . . 0.0 111.529 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.659 HD13 HG23 ' A' ' 6' ' ' THR . 32.9 mm -130.81 128.98 63.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.778 -0.647 . . . . 0.0 109.409 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.483 ' CG ' ' HB2' ' A' ' 5' ' ' ARG . 10.5 pt20 . . . . . 0 C--N 1.327 -0.4 0 CA-C-O 121.078 0.466 . . . . 0.0 110.375 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 N--CA 1.454 -0.829 0 CA-C-O 121.006 0.336 . . . . 0.0 112.108 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.62 ' HG3' ' HB3' ' A' ' 57' ' ' ASP . 13.8 pt20 -70.35 158.83 35.24 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 175.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.505 ' HG2' ' HA ' ' A' ' 56' ' ' GLU . 99.4 mtt180 -128.28 148.28 50.64 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.305 0.574 . . . . 0.0 111.596 -170.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.647 HG23 HD13 ' A' ' 93' ' ' ILE . 69.8 m -123.16 136.13 54.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.518 -177.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.422 ' HB2' ' CE2' ' A' ' 54' ' ' TRP . 68.5 ttt180 -99.93 111.69 23.99 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.757 ' HD2' HD21 ' A' ' 55' ' ' LEU . 12.4 m-85 -104.61 138.33 41.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.366 0.603 . . . . 0.0 111.549 -178.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.732 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 19.4 m -111.56 133.41 53.85 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 170.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.665 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.33 145.68 23.35 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.04 -174.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.68 HG12 ' HB ' ' A' ' 87' ' ' ILE . 3.3 pt -139.75 148.18 23.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -99.65 112.63 24.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.914 0.387 . . . . 0.0 110.667 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 21.7 p -96.12 144.84 26.0 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.186 176.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -84.88 -21.36 29.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.997 -169.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.485 ' O ' ' HB2' ' A' ' 18' ' ' GLU . 4.1 m -147.65 164.57 33.11 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.571 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 26.9 tt0 -69.71 -27.28 64.86 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.17 -39.47 82.61 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.477 172.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.619 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 5.8 mm-40 -64.23 -41.09 97.16 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.935 -1.029 . . . . 0.0 110.165 175.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.57 ' O ' ' HG ' ' A' ' 23' ' ' LEU . . . -63.18 -47.29 83.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.669 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 16' ' ' GLU . 74.4 mmtt -55.01 -44.11 74.25 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.156 0.503 . . . . 0.0 110.789 178.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.99 -37.07 72.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.151 -179.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.612 HG22 ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -76.2 -38.38 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.745 -175.416 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 19' ' ' ALA . 4.2 pp -72.61 -28.42 62.77 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 121.104 -0.239 . . . . 0.0 111.279 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.524 ' N ' HD12 ' A' ' 23' ' ' LEU . 30.3 t70 -58.01 -41.12 82.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.674 0.274 . . . . 0.0 111.553 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.672 ' HB3' HD21 ' A' ' 35' ' ' LEU . 0.7 OUTLIER -71.37 -44.04 65.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.104 0.478 . . . . 0.0 109.855 -179.367 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.593 ' HB3' ' CD1' ' A' ' 35' ' ' LEU . 3.8 pp -73.16 -16.94 61.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.674 -178.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.89 -25.01 60.92 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.235 0.54 . . . . 0.0 109.667 172.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -84.96 -24.55 28.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.918 0.866 . . . . 0.0 108.784 170.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.03 39.91 36.45 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 114.104 -1.407 . . . . 0.0 112.486 175.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.47 -64.46 1.44 Allowed Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 118.526 -1.797 . . . . 0.0 112.512 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.479 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 45.3 t0 -141.8 114.98 8.79 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 117.142 0.471 . . . . 0.0 111.127 170.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.631 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 32.8 t80 -77.47 -31.98 54.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.107 0.48 . . . . 0.0 109.747 173.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.475 ' HB1' ' HA2' ' A' ' 49' ' ' GLY . . . -64.62 -31.64 72.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.712 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.65 -40.85 84.52 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.357 0.599 . . . . 0.0 109.944 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' A' ' 25' ' ' GLU . 14.0 mt -62.25 -44.89 95.51 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.458 178.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.533 ' O ' ' HB2' ' A' ' 40' ' ' SER . . . -56.99 -47.48 80.69 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.592 -1.185 . . . . 0.0 111.529 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.525 ' HG2' ' HA ' ' A' ' 47' ' ' ARG . 39.4 mtpt -79.89 -32.99 40.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.153 -172.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -80.36 -60.7 2.22 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -169.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.619 ' HD3' ' HB3' ' A' ' 18' ' ' GLU . 1.1 ttmm -103.11 -25.05 13.54 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.984 0.897 . . . . 0.0 112.813 -170.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.564 ' O ' HG23 ' A' ' 43' ' ' ILE . 7.5 m -75.31 143.34 42.98 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.519 -169.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -79.19 1.61 23.96 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.611 0.719 . . . . 0.0 110.24 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.568 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 27.8 t70 -65.82 -16.65 64.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.395 176.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 1.014 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 3.5 pt -56.21 -17.88 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 114.579 1.325 . . . . 0.0 114.579 -157.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 71.0 mt -51.74 -39.8 25.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.268 0.556 . . . . 0.0 110.014 167.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 35.4 t -112.41 -28.96 7.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.345 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 1.014 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -51.71 -29.36 18.09 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -175.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.525 ' HA ' ' HG2' ' A' ' 37' ' ' LYS . 89.8 mtt180 -63.71 -8.84 11.44 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.8 p30 -90.38 10.32 25.49 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.958 0.409 . . . . 0.0 110.991 170.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.475 ' HA2' ' HB1' ' A' ' 33' ' ' ALA . . . 92.26 26.51 18.24 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 116.141 -0.482 . . . . 0.0 112.976 -176.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.42 20.06 79.79 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 121.62 -0.324 . . . . 0.0 113.364 173.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -97.0 122.94 40.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.014 0.435 . . . . 0.0 111.033 -176.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.548 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 27.0 ptm -82.68 -19.67 37.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.834 176.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 113.69 -171.22 13.69 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.0 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.535 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 84.4 m95 -90.68 125.47 35.67 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.004 0.43 . . . . 0.0 111.143 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.757 HD21 ' HD2' ' A' ' 8' ' ' TYR . 2.7 pp -115.33 156.51 25.36 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 173.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.516 ' O ' ' HB ' ' A' ' 59' ' ' THR . 25.3 mt-10 -81.67 132.26 35.29 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.964 0.412 . . . . 0.0 110.092 -177.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.62 ' HB3' ' HG3' ' A' ' 4' ' ' GLN . 31.9 t70 -73.22 145.32 46.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.277 -175.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 62.9 7.56 2.69 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.422 -172.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 56' ' ' GLU . 13.6 m -112.11 3.01 17.03 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.701 HG12 HD13 ' A' ' 55' ' ' LEU . 21.8 mt -73.59 133.59 79.88 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 113.835 -1.53 . . . . 0.0 110.865 -173.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.75 155.61 53.11 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.801 2.334 . . . . 0.0 111.839 174.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.664 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 8.9 m-20 -55.54 -27.51 49.31 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.048 -0.978 . . . . 0.0 112.708 -171.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.97 -55.49 32.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.936 178.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.514 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 5.2 mp -83.45 -16.59 45.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.532 -177.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.664 ' HD2' ' HA ' ' A' ' 62' ' ' ASP . 67.6 mttm -56.86 -44.12 81.85 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.602 0.715 . . . . 0.0 109.602 172.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -75.67 -5.34 45.09 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.017 -176.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.838 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -71.33 -31.09 66.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.037 0.446 . . . . 0.0 111.049 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 77.48 19.08 76.92 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.935 175.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.717 HD12 HG22 ' A' ' 88' ' ' VAL . 11.8 mt -96.11 87.26 4.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.839 0.352 . . . . 0.0 111.309 -177.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -100.69 -41.44 6.91 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -177.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.513 ' O ' HD13 ' A' ' 90' ' ' LEU . 31.5 tt0 -100.32 135.33 41.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.853 0.358 . . . . 0.0 111.351 -174.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.477 ' HE3' ' O ' ' A' ' 91' ' ' ASP . 1.6 tmtp? -66.48 135.39 54.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.522 -170.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.58 -11.96 39.08 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.495 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.513 ' HB3' HD12 ' A' ' 90' ' ' LEU . 10.1 tt0 -83.9 127.8 34.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.159 0.504 . . . . 0.0 110.705 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.586 HD13 HD12 ' A' ' 26' ' ' LEU . 1.4 pp -138.27 170.3 16.27 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.345 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.9 t 78.64 60.37 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 124.106 0.879 . . . . 0.0 111.093 -178.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -110.88 120.31 5.49 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 170.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 25.8 t -107.91 113.51 43.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.216 0.531 . . . . 0.0 110.346 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.489 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 43.9 mm -103.84 118.12 50.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.249 -178.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 85' ' ' PHE . 86.4 tttt -82.87 130.32 35.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.402 0.62 . . . . 0.0 111.164 -178.081 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.3 m -126.96 166.92 16.62 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.041 173.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.3 m -79.04 -26.02 43.16 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.496 0.665 . . . . 0.0 109.337 177.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 33.6 m -85.47 -5.84 10.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.531 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.25 -157.24 27.12 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.884 -0.675 . . . . 0.0 111.851 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.535 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 83.1 m-85 -124.85 136.55 53.91 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 117.035 0.417 . . . . 0.0 110.333 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.665 HD11 ' HB ' ' A' ' 10' ' ' ILE . 57.1 tp -107.78 135.49 49.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.775 0.321 . . . . 0.0 110.382 -178.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.68 ' HB ' HG12 ' A' ' 11' ' ' ILE . 24.9 mm -108.95 127.55 65.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.838 HG11 ' HB1' ' A' ' 67' ' ' ALA . 11.1 p -112.78 141.01 29.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.268 0.556 . . . . 0.0 110.542 -176.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.732 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 1.5 tmm_? -142.16 130.92 22.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.879 -174.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.676 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.8 mt -87.4 109.68 19.74 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 120.702 0.287 . . . . 0.0 111.31 178.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.477 ' O ' ' HE3' ' A' ' 72' ' ' LYS . 11.9 t70 -79.42 -53.92 6.43 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.662 177.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.535 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 28.7 t0 -156.0 164.52 38.35 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.932 -0.307 . . . . 0.0 111.781 -178.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.647 HD13 HG23 ' A' ' 6' ' ' THR . 26.6 mm -134.65 123.84 42.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.125 176.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.513 ' HG2' ' CZ3' ' A' ' 54' ' ' TRP . 28.9 pt20 . . . . . 0 C--N 1.327 -0.387 0 CA-C-O 121.025 0.441 . . . . 0.0 110.603 178.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo . . . . . 0 N--CA 1.459 -0.523 0 CA-C-O 121.211 0.421 . . . . 0.0 112.891 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -75.59 158.65 32.18 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.132 176.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.491 ' HE ' ' HG2' ' A' ' 56' ' ' GLU . 99.7 mtt180 -121.85 145.73 47.79 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.437 0.637 . . . . 0.0 112.11 -171.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 26.1 m -135.09 141.22 46.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.384 -176.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.586 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 57.3 ttt180 -100.4 111.91 24.22 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 177.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.5 ' HE1' ' HB3' ' A' ' 69' ' ' LEU . 23.1 m-85 -106.67 139.67 40.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.154 0.502 . . . . 0.0 111.569 -178.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 50' ' ' GLY . 9.8 m -117.49 132.38 56.56 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 171.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.69 ' HB ' HD21 ' A' ' 86' ' ' LEU . 2.7 pp -140.69 145.31 25.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -174.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.637 HG21 ' HA ' ' A' ' 36' ' ' ALA . 7.3 pt -140.46 138.56 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -98.13 118.32 34.48 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.986 0.422 . . . . 0.0 110.163 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.736 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 52.7 p -94.34 149.65 21.03 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.246 174.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.54 ' HB2' ' OE2' ' A' ' 18' ' ' GLU . 25.2 mttp -77.75 -25.47 49.21 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.497 -173.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -141.97 168.25 20.2 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.357 176.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.432 ' HB2' ' CZ ' ' A' ' 85' ' ' PHE . 23.9 tt0 -64.68 -32.95 74.84 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -53.71 -41.68 67.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.632 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.736 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 49.9 mt-10 -69.68 -41.31 75.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.384 178.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.545 ' HA ' HD11 ' A' ' 87' ' ' ILE . . . -59.41 -39.1 82.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.405 178.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -55.32 -50.91 68.39 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.812 0.339 . . . . 0.0 110.775 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.21 -30.87 70.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.08 -177.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.815 HG22 ' HE3' ' A' ' 39' ' ' LYS . 21.9 t -75.51 -52.2 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.899 -0.592 . . . . 0.0 109.806 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.438 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -66.48 -28.45 68.59 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.051 -176.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.419 ' N ' HD12 ' A' ' 23' ' ' LEU . 17.8 t70 -64.24 -44.2 92.56 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.025 0.441 . . . . 0.0 110.369 175.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.421 ' HG2' HD21 ' A' ' 35' ' ' LEU . 4.2 tp10 -75.53 -45.45 38.01 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.98 -175.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.863 HD13 HD13 ' A' ' 75' ' ' LEU . 3.1 pp -72.55 -14.93 61.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.746 0.308 . . . . 0.0 110.984 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.481 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -63.01 -27.69 69.59 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 174.009 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.03 -25.62 17.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.767 0.794 . . . . 0.0 109.373 173.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.45 45.63 13.75 Favored Glycine 0 N--CA 1.448 -0.514 0 CA-C-N 114.597 -1.183 . . . . 0.0 113.879 168.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.28 -64.26 1.66 Allowed Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 118.706 -1.711 . . . . 0.0 112.593 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.515 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 45.3 t0 -141.1 115.91 9.71 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 117.109 0.454 . . . . 0.0 111.474 171.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.412 ' HA ' HD12 ' A' ' 35' ' ' LEU . 60.8 t80 -77.19 -33.14 56.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.817 0.342 . . . . 0.0 110.374 174.466 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.3 -30.34 71.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.815 -177.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.6 -42.21 71.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.425 0.631 . . . . 0.0 109.552 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 31' ' ' ASP . 13.0 mt -61.28 -45.05 96.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.1 -0.954 . . . . 0.0 109.258 176.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.637 ' HA ' HG21 ' A' ' 11' ' ' ILE . . . -56.19 -51.05 69.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.31 -1.314 . . . . 0.0 112.244 -176.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.669 ' HG2' ' HA ' ' A' ' 47' ' ' ARG . 54.0 mtpt -78.21 -22.65 48.2 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.782 -170.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -80.09 -59.8 2.58 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.815 ' HE3' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -103.33 -22.88 13.63 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -171.834 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.417 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 0.7 OUTLIER -75.18 147.67 40.23 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.413 -163.704 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.15 4.12 24.49 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.826 0.822 . . . . 0.0 109.651 174.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.797 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 14.6 t70 -68.92 -15.05 63.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.383 -1.281 . . . . 0.0 112.146 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.973 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.4 pp -54.81 -14.97 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -153.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.859 ' H ' HD12 ' A' ' 44' ' ' ILE . 4.1 mp -51.62 -40.48 25.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 166.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.7 p -120.04 -6.16 9.99 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.675 177.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.973 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -71.39 -29.88 65.45 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.923 -0.486 . . . . 0.0 111.091 179.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.669 ' HA ' ' HG2' ' A' ' 37' ' ' LYS . 79.7 mtp180 -59.09 -28.58 66.63 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.668 -177.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.407 HD22 ' HB3' ' A' ' 51' ' ' ASP . 2.8 p-10 -90.09 13.24 15.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.131 0.491 . . . . 0.0 110.903 176.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.59 21.87 30.43 Favored Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.959 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.413 ' O ' ' HA ' ' A' ' 9' ' ' SER . . . 72.37 11.34 76.02 Favored Glycine 0 C--N 1.327 0.062 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.185 175.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.407 ' HB3' HD22 ' A' ' 48' ' ' ASN . 4.4 t70 -76.3 115.76 16.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.341 -0.429 . . . . 0.0 110.781 -178.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.528 ' SD ' HG12 ' A' ' 10' ' ' ILE . 88.1 mtp -79.6 -20.94 45.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.319 0.58 . . . . 0.0 109.606 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 107.83 -162.17 13.3 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.046 -177.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -95.55 119.26 33.74 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.904 0.383 . . . . 0.0 110.811 178.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.482 HD13 ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -108.7 155.85 20.25 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.193 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.491 ' HG2' ' HE ' ' A' ' 5' ' ' ARG . 40.2 mt-10 -93.99 131.07 39.82 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.532 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -61.53 148.94 40.45 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.402 -174.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 63.87 6.77 2.9 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.711 -174.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 5.1 m -112.18 -0.74 15.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 122.24 1.019 . . . . 0.0 108.764 168.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.651 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 24.3 mt -75.2 137.61 72.07 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.524 -175.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.52 ' HG2' HD13 ' A' ' 64' ' ' LEU . 18.8 Cg_endo -61.37 146.12 97.54 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.345 2.03 . . . . 0.0 111.244 174.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.646 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 7.8 p-10 -56.59 -24.0 44.53 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.251 -172.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -57.64 -49.03 77.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.356 0.41 . . . . 0.0 110.802 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.52 HD13 ' HG2' ' A' ' 61' ' ' PRO . 6.4 mp -83.1 -15.34 51.23 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.317 -178.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.651 ' HE3' ' O ' ' A' ' 60' ' ' ILE . 94.2 mttt -64.08 -34.32 77.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.584 0.707 . . . . 0.0 110.089 174.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -71.8 -5.72 36.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.527 -178.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.618 ' HB1' HD13 ' A' ' 69' ' ' LEU . . . -70.85 -39.16 73.12 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.088 0.47 . . . . 0.0 111.227 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 72.13 15.4 76.62 Favored Glycine 0 C--N 1.332 0.345 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.132 -174.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.622 ' C ' HD11 ' A' ' 90' ' ' LEU . 6.7 mp -81.33 78.69 8.09 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -174.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.406 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 70.7 mmtt -102.44 -16.62 16.12 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 175.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -109.08 125.52 52.22 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 122.214 -0.304 . . . . 0.0 111.278 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.799 ' HB2' HD13 ' A' ' 93' ' ' ILE . 87.5 tttt -66.11 133.4 50.65 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.22 0.533 . . . . 0.0 112.139 -169.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 101.58 -3.88 53.73 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.253 -177.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.646 ' HB3' HD12 ' A' ' 90' ' ' LEU . 10.2 tt0 -80.44 114.43 19.34 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 121.31 0.576 . . . . 0.0 109.722 175.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.863 HD13 HD13 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -133.64 169.78 16.52 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.911 178.8 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.618 ' HB2' HD11 ' A' ' 26' ' ' LEU . 18.5 t 78.56 46.2 0.05 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 122.007 0.908 . . . . 0.0 110.358 -174.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -96.96 103.74 2.95 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 167.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 17.7 t -103.09 113.13 38.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -174.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 59.9 mt -94.1 109.43 22.03 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.602 -177.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.428 ' HD2' ' HE2' ' A' ' 85' ' ' PHE . 26.0 tttt -75.28 113.69 12.95 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.391 -174.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.561 ' HB2' ' O ' ' A' ' 84' ' ' GLY . 14.9 m -126.75 137.87 53.3 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.403 -1.271 . . . . 0.0 107.936 173.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.8 p -62.47 -26.02 68.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.352 -175.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 19.9 m -79.59 -19.4 12.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.297 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . 0.561 ' O ' ' HB2' ' A' ' 81' ' ' SER . . . 161.08 163.59 14.38 Favored Glycine 0 N--CA 1.444 -0.787 0 N-CA-C 111.006 -0.837 . . . . 0.0 111.006 -175.045 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.432 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 57.8 m-85 -109.6 127.96 54.88 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 120.77 0.319 . . . . 0.0 110.798 -172.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.69 HD21 ' HB ' ' A' ' 10' ' ' ILE . 1.2 tt -111.16 138.49 47.54 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 121.545 0.688 . . . . 0.0 110.666 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.591 ' N ' HD23 ' A' ' 86' ' ' LEU . 6.5 mt -117.46 121.37 67.42 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 CA-C-N 114.557 -1.202 . . . . 0.0 110.588 -175.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.54 HG22 HD22 ' A' ' 69' ' ' LEU . 7.1 p -113.06 141.38 28.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.667 -176.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.724 ' HB2' ' HB3' ' A' ' 75' ' ' LEU . 2.8 ptm180 -138.45 158.31 44.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.449 0.642 . . . . 0.0 110.72 174.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.871 HD22 HD11 ' A' ' 93' ' ' ILE . 12.9 mt -96.57 109.6 22.17 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.207 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.586 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 21.7 t70 -79.56 -53.91 6.41 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.052 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.486 ' C ' HD12 ' A' ' 93' ' ' ILE . 43.2 t0 -155.03 160.57 41.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.741 -177.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.871 HD11 HD22 ' A' ' 90' ' ' LEU . 1.7 mp -128.87 136.05 60.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.092 -0.503 . . . . 0.0 109.879 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 . . . . . 0 C--N 1.331 -0.217 0 CA-C-O 120.871 0.367 . . . . 0.0 111.322 178.645 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo . . . . . 0 N--CA 1.446 -1.305 0 CA-C-O 121.054 0.356 . . . . 0.0 111.482 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.615 ' HG3' ' HB3' ' A' ' 57' ' ' ASP . 12.7 pt20 -80.74 158.8 25.39 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.663 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 49.6 mtt180 -128.99 151.21 49.93 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.08 0.467 . . . . 0.0 111.51 -171.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.9 m -128.62 131.12 48.08 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.717 176.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.539 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 58.8 ttt180 -95.61 111.74 23.61 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.68 -0.408 . . . . 0.0 109.9 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.681 ' HD2' HD21 ' A' ' 55' ' ' LEU . 22.4 m-85 -106.43 146.47 30.47 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.481 0.658 . . . . 0.0 111.131 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.471 ' HB2' ' HE ' ' A' ' 89' ' ' ARG . 16.2 m -125.86 132.52 52.17 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 169.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.676 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.9 pp -136.67 149.14 26.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 -175.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.678 HD11 HG11 ' A' ' 22' ' ' VAL . 5.3 pt -140.32 147.59 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 177.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -103.99 121.32 42.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.386 -176.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.779 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 73.8 p -97.86 153.76 18.1 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.61 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -84.9 -25.57 27.85 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.219 -175.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.0 m -149.9 165.24 33.19 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 176.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.688 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 30.6 tt0 -56.12 -39.34 72.07 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.047 0.451 . . . . 0.0 110.384 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -57.53 -38.6 74.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.918 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.976 ' HB3' ' HD2' ' A' ' 39' ' ' LYS . 10.9 mm-40 -64.89 -36.28 83.85 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.82 -176.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.629 ' HA ' HD11 ' A' ' 87' ' ' ILE . . . -70.69 -38.61 73.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.595 178.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.688 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.0 mmtp -58.51 -43.66 89.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.308 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.06 -34.27 77.64 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.817 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.678 HG11 HD11 ' A' ' 11' ' ' ILE . 92.1 t -73.52 -49.25 37.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.331 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.669 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.5 pp -65.72 -28.54 69.13 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.215 -176.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.453 ' N ' HD12 ' A' ' 23' ' ' LEU . 19.2 t70 -63.8 -46.47 85.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.097 0.475 . . . . 0.0 110.412 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -75.07 -38.85 61.18 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.854 -175.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.115 HD11 ' HB3' ' A' ' 76' ' ' SER . 2.7 pp -72.71 -17.09 61.66 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.153 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.509 ' N ' HD12 ' A' ' 26' ' ' LEU . 2.0 m-80 -69.35 -21.16 63.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.121 0.486 . . . . 0.0 110.139 175.111 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -77.63 -26.2 50.36 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 172.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.13 31.32 52.96 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-N 114.486 -1.234 . . . . 0.0 112.627 173.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -91.2 -64.11 1.18 Allowed Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 118.758 -1.687 . . . . 0.0 113.301 -177.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.452 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 8.0 t0 -140.1 115.47 9.94 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 122.76 -0.259 . . . . 0.0 111.351 177.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.481 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 93.1 t80 -85.4 -41.31 15.55 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.96 0.41 . . . . 0.0 110.893 172.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.74 -33.81 61.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.259 -178.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.32 -44.52 75.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.311 178.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 31' ' ' ASP . 12.4 mt -60.57 -38.36 84.33 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.636 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.54 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -59.53 -50.93 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.502 179.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -69.61 -35.33 75.17 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.921 -173.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.49 -55.48 5.18 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -175.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.976 ' HD2' ' HB3' ' A' ' 18' ' ' GLU . 1.0 OUTLIER -96.73 -24.04 16.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.701 0.762 . . . . 0.0 112.869 -166.373 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.629 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 29.0 t -93.44 147.38 23.01 Favored 'General case' 0 C--N 1.291 -1.94 0 O-C-N 121.514 -0.741 . . . . 0.0 112.93 -167.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.53 0.62 41.76 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.11 174.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.663 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 31.4 t70 -59.87 -14.69 16.44 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.46 -1.246 . . . . 0.0 112.666 178.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 1.046 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.5 pp -54.73 -14.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -152.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.431 ' N ' HD12 ' A' ' 43' ' ' ILE . 44.3 mm -51.82 -33.04 15.19 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 CA-C-O 121.378 0.608 . . . . 0.0 109.539 165.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.8 m -119.62 -20.39 7.73 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.212 174.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 1.046 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -64.32 -29.98 71.04 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 121.84 -0.537 . . . . 0.0 111.767 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -57.15 -34.28 68.25 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.603 0.239 . . . . 0.0 111.521 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -88.71 13.87 11.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.233 0.54 . . . . 0.0 110.934 176.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.78 24.66 22.6 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.342 -0.844 . . . . 0.0 113.049 178.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.02 14.2 76.1 Favored Glycine 0 CA--C 1.51 -0.254 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.129 174.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -85.58 115.8 23.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.897 0.379 . . . . 0.0 110.311 -176.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.426 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 26.1 ptm -80.64 -19.62 44.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.118 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 115.02 -166.61 12.18 Favored Glycine 0 N--CA 1.439 -1.128 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.737 -178.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.792 ' CZ3' ' HB2' ' A' ' 94' ' ' GLN . 82.4 m95 -98.85 113.37 25.46 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.914 0.387 . . . . 0.0 111.081 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.725 HD13 HG12 ' A' ' 60' ' ' ILE . 2.6 pp -99.64 153.31 19.17 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.372 173.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -84.92 132.72 34.34 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.615 ' HB3' ' HG3' ' A' ' 4' ' ' GLN . 23.8 t70 -67.56 145.39 54.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.292 -175.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 65.4 7.13 4.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.903 -173.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.8 m -112.72 9.32 19.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 122.032 0.92 . . . . 0.0 108.828 166.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.725 HG12 HD13 ' A' ' 55' ' ' LEU . 6.0 mt -81.94 137.79 46.64 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.705 -172.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 60' ' ' ILE . 31.9 Cg_exo -61.27 152.36 72.77 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.742 2.295 . . . . 0.0 111.582 176.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.03 -25.26 66.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.77 -168.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.552 ' HA ' ' ND2' ' A' ' 66' ' ' ASN . 41.1 tt0 -70.01 -25.88 63.8 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.377 0.608 . . . . 0.0 110.257 177.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.598 ' HB2' HG22 ' A' ' 60' ' ' ILE . 4.4 mm? -80.93 -22.85 39.33 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.116 176.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -72.97 -44.75 60.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.541 178.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.552 ' ND2' ' HA ' ' A' ' 63' ' ' GLU . 5.0 p30 -74.46 -6.06 46.14 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.967 0.413 . . . . 0.0 110.435 -177.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.954 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -62.83 -32.22 73.38 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.402 173.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.22 26.82 54.28 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.889 175.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.684 HD12 HG22 ' A' ' 88' ' ' VAL . 10.3 mt -102.64 86.88 2.85 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.839 0.352 . . . . 0.0 111.714 -176.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -101.25 -41.9 6.53 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.671 176.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -94.18 127.87 40.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.92 0.391 . . . . 0.0 111.825 -175.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.836 ' HE2' ' HA ' ' A' ' 92' ' ' ASP . 51.0 tttm -66.71 133.77 50.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.267 -172.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.04 -8.41 38.79 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.25 -0.74 . . . . 0.0 111.25 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -86.93 128.09 35.06 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.143 0.497 . . . . 0.0 109.996 178.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.677 HD12 ' HB2' ' A' ' 26' ' ' LEU . 2.2 pt? -144.62 169.9 17.1 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.823 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 1.115 ' HB3' HD11 ' A' ' 26' ' ' LEU . 57.4 p 78.1 45.79 0.06 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.476 1.51 . . . . 0.0 111.266 -171.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -91.56 103.98 3.11 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 168.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 16.8 t -97.96 113.6 33.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.172 0.51 . . . . 0.0 109.855 -174.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.6 HD11 ' HA ' ' A' ' 67' ' ' ALA . 49.9 mm -103.99 124.07 58.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.439 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -82.56 126.23 32.04 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.132 0.491 . . . . 0.0 110.51 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.7 t -129.53 158.84 38.13 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 175.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.5 p -66.37 -25.84 66.98 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.958 0.409 . . . . 0.0 110.764 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 34.9 m -83.27 -11.36 11.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.423 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.95 -161.39 27.82 Favored Glycine 0 C--O 1.226 -0.366 0 N-CA-C 111.502 -0.639 . . . . 0.0 111.502 -177.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.599 ' HB2' ' OG1' ' A' ' 13' ' ' THR . 95.3 m-85 -111.14 138.68 47.27 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 117.334 0.567 . . . . 0.0 110.842 -178.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.676 HD11 ' HB ' ' A' ' 10' ' ' ILE . 36.2 tp -114.53 135.71 53.82 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.944 -177.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.629 HD11 ' HA ' ' A' ' 19' ' ' ALA . 15.7 mt -113.23 121.21 65.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.306 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.954 HG11 ' HB1' ' A' ' 67' ' ' ALA . 14.8 p -106.28 140.42 24.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.071 -175.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.481 ' HD3' ' CG ' ' A' ' 32' ' ' PHE . 15.3 ttp85 -132.23 141.79 49.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.792 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.665 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.0 mt -94.55 108.83 20.77 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.448 175.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.539 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 22.6 t70 -80.62 -54.98 5.17 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.098 -0.641 . . . . 0.0 111.815 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.836 ' HA ' ' HE2' ' A' ' 72' ' ' LYS . 9.1 t70 -156.63 170.13 23.1 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.165 -174.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.43 HG12 ' HB2' ' A' ' 72' ' ' LYS . 45.5 mm -127.59 120.05 53.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.792 ' HB2' ' CZ3' ' A' ' 54' ' ' TRP . 6.9 tt0 . . . . . 0 C--N 1.326 -0.435 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -169.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo . . . . . 0 N--CA 1.457 -0.647 0 CA-C-O 120.925 0.302 . . . . 0.0 112.11 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -70.31 158.46 35.88 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.632 ' HE ' ' HG2' ' A' ' 56' ' ' GLU . 99.1 mtt180 -122.31 135.39 54.72 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.47 0.652 . . . . 0.0 111.741 -173.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.632 HG23 HD13 ' A' ' 93' ' ' ILE . 32.0 m -120.46 137.42 54.35 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.205 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.553 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 62.8 ttt180 -96.25 110.88 23.1 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 177.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.694 ' HD2' HD21 ' A' ' 55' ' ' LEU . 19.2 m-85 -109.27 137.59 46.92 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.144 0.497 . . . . 0.0 111.328 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.701 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 15.3 m -109.8 132.31 54.27 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.464 -0.789 . . . . 0.0 108.913 169.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.739 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.9 pp -142.73 143.82 25.08 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -177.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.688 HD11 HG11 ' A' ' 22' ' ' VAL . 12.4 pt -140.18 146.57 24.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.24 175.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -97.41 118.74 34.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.102 0.477 . . . . 0.0 110.386 -177.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.518 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 41.3 p -98.06 154.56 17.64 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.516 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.674 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 72.7 mmtt -67.2 -37.63 83.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.024 -176.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.453 HG22 ' H ' ' A' ' 16' ' ' GLU . 2.7 m -152.37 171.32 18.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.835 -176.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.579 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 39.3 tt0 -61.7 -35.26 77.51 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-O 121.219 0.533 . . . . 0.0 109.677 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -56.32 -43.27 78.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.413 175.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.674 ' HG3' ' HB2' ' A' ' 14' ' ' LYS . 6.5 mm-40 -61.52 -41.21 96.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.33 177.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.585 ' HB1' HD11 ' A' ' 87' ' ' ILE . . . -60.78 -41.6 95.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.698 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.579 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.5 mmtp -55.63 -49.07 73.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.563 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -31.41 72.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.016 0.436 . . . . 0.0 111.022 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.688 HG11 HD11 ' A' ' 11' ' ' ILE . 62.8 t -73.78 -51.28 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.172 178.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.602 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 4.5 pp -65.45 -30.67 71.48 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.595 -174.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.535 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 15.3 t70 -57.18 -53.99 51.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.942 0.401 . . . . 0.0 110.798 -178.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -73.79 -33.69 64.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.638 -175.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.748 HD11 ' HB2' ' A' ' 76' ' ' SER . 3.6 pp -73.17 -21.25 60.73 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.345 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -70.53 -30.2 66.88 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.052 0.453 . . . . 0.0 109.978 172.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -69.43 -31.6 70.03 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 171.656 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.28 33.12 29.57 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.773 -1.103 . . . . 0.0 113.049 171.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.56 -64.3 1.21 Allowed Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 118.932 -1.604 . . . . 0.0 112.887 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -140.54 118.66 11.95 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.049 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.57 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 32.0 t80 -84.34 -31.21 24.93 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 175.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.456 ' CB ' ' HA2' ' A' ' 49' ' ' GLY . . . -60.68 -34.44 74.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.071 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.77 88.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.319 0.581 . . . . 0.0 110.084 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.701 ' CD1' ' HB3' ' A' ' 26' ' ' LEU . 6.6 mt -66.35 -42.87 87.44 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.94 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.51 ' CB ' HG21 ' A' ' 11' ' ' ILE . . . -64.06 -54.42 34.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.596 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.412 ' HA ' HG22 ' A' ' 43' ' ' ILE . 40.0 mtpt -70.16 -32.07 69.85 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.215 -169.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -81.18 -60.01 2.44 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 2.5 ttmm -102.16 -26.03 13.5 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 116.101 1.889 . . . . 0.0 116.101 -167.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.435 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 52.8 p -81.08 162.17 23.85 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 121.536 -0.728 . . . . 0.0 112.833 -170.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.7 3.43 29.12 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.194 174.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.521 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 36.1 t70 -71.46 -16.29 62.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.444 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.96 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.9 pp -56.18 -16.44 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -157.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.733 ' H ' HD12 ' A' ' 44' ' ' ILE . 4.1 mp -57.57 -41.09 78.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.117 0.484 . . . . 0.0 109.936 170.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.5 m -109.43 -14.35 14.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.294 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.96 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -53.04 -28.69 25.75 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.836 0.454 . . . . 0.0 112.142 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 87.8 mtt180 -53.45 -26.71 21.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.319 178.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.487 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 85.9 m-20 -79.43 -0.38 32.73 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.86 0.362 . . . . 0.0 110.885 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.456 ' HA2' ' CB ' ' A' ' 33' ' ' ALA . . . 90.89 33.25 8.41 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 111.359 -0.697 . . . . 0.0 111.359 -173.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.535 ' O ' ' HA ' ' A' ' 9' ' ' SER . . . 71.33 11.01 70.95 Favored Glycine 0 C--N 1.334 0.434 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -175.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.487 ' HB3' ' HB3' ' A' ' 48' ' ' ASN . 9.4 t70 -76.74 119.28 20.3 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.124 -0.538 . . . . 0.0 111.924 -172.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 77.9 mmm -77.66 -21.4 52.19 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.495 172.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 102.8 -169.49 19.18 Favored Glycine 0 N--CA 1.437 -1.27 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.011 -176.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.479 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 93.8 m95 -88.13 112.75 23.04 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.181 0.515 . . . . 0.0 110.824 178.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.694 HD21 ' HD2' ' A' ' 8' ' ' TYR . 2.9 pp -105.14 154.7 19.83 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.686 177.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.632 ' HG2' ' HE ' ' A' ' 5' ' ' ARG . 22.8 mt-10 -88.39 127.99 35.51 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -64.12 151.35 43.44 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 73.02 8.9 5.41 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.02 0.825 . . . . 0.0 111.544 -175.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.2 p -111.49 -0.17 16.3 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 164.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.472 ' CG2' ' HB2' ' A' ' 64' ' ' LEU . 59.5 mt -78.18 129.91 73.91 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.6 -171.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 60' ' ' ILE . 20.8 Cg_exo -66.77 156.97 63.48 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 123.138 2.559 . . . . 0.0 111.916 175.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.67 -26.86 57.45 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.16 -0.927 . . . . 0.0 112.521 -173.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.465 ' HG3' HG21 ' A' ' 79' ' ' ILE . 0.4 OUTLIER -55.74 -52.37 64.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.369 . . . . 0.0 110.795 177.323 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.472 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 6.0 mp -83.09 -12.47 57.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.942 -178.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -67.33 -49.09 65.51 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 172.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -68.05 -13.36 62.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.346 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.846 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -64.67 -27.83 69.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.18 0.514 . . . . 0.0 110.84 177.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 65.38 27.04 72.03 Favored Glycine 0 C--N 1.334 0.462 0 CA-C-N 115.123 -0.944 . . . . 0.0 113.373 174.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.72 HD12 HG22 ' A' ' 88' ' ' VAL . 12.5 mt -97.15 71.22 2.41 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.8 0.333 . . . . 0.0 111.778 -175.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.444 ' HD3' ' HA ' ' A' ' 70' ' ' LYS . 44.2 mmtm -101.97 -25.74 13.66 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.779 0.323 . . . . 0.0 111.663 175.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -92.96 120.94 33.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.844 ' HD2' ' HA ' ' A' ' 92' ' ' ASP . 37.3 ttpt -67.1 144.69 55.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.263 0.554 . . . . 0.0 111.95 -170.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 99.91 -16.3 58.59 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.382 -177.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.435 ' HB3' HD12 ' A' ' 90' ' ' LEU . 9.3 tt0 -81.58 122.89 28.16 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.156 0.503 . . . . 0.0 110.407 -178.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.723 HD13 HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -142.27 169.63 17.23 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.775 -178.493 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.748 ' HB2' HD11 ' A' ' 26' ' ' LEU . 30.8 t 78.49 56.12 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 O-C-N 124.277 0.986 . . . . 0.0 110.775 -176.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -102.83 117.06 5.66 Favored Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 109.919 -1.272 . . . . 0.0 109.919 169.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 14.3 t -99.24 113.45 34.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.002 0.429 . . . . 0.0 109.957 -174.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.465 HG21 ' HG3' ' A' ' 63' ' ' GLU . 38.9 mm -110.64 120.27 61.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.258 -179.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -81.68 132.02 35.28 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.064 0.459 . . . . 0.0 111.059 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.0 m -114.93 167.09 11.09 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.49 -0.777 . . . . 0.0 108.917 172.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.5 t -72.46 -26.32 61.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.005 0.431 . . . . 0.0 109.866 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.6 m -97.64 -5.54 9.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.265 -177.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.77 -155.77 27.22 Favored Glycine 0 C--O 1.227 -0.342 0 C-N-CA 120.346 -0.93 . . . . 0.0 112.47 -178.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.492 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 82.1 m-85 -127.28 134.73 50.0 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.0 110.782 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.739 HD11 ' HB ' ' A' ' 10' ' ' ILE . 51.0 tp -110.53 135.47 51.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.438 -177.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.685 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 34.7 mm -107.45 126.77 63.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.961 178.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.846 HG11 ' HB1' ' A' ' 67' ' ' ALA . 11.7 p -108.12 140.61 25.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.056 0.455 . . . . 0.0 110.53 -178.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.716 ' HG2' ' HB3' ' A' ' 75' ' ' LEU . 2.5 tmm_? -142.31 133.21 25.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.654 -174.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.717 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 12.7 mt -89.09 109.7 20.51 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 176.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.553 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 20.2 t70 -80.44 -54.14 5.96 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.358 176.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.844 ' HA ' ' HD2' ' A' ' 72' ' ' LYS . 28.3 t70 -155.35 168.7 26.24 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.545 -179.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.632 HD13 HG23 ' A' ' 6' ' ' THR . 31.4 mm -129.97 131.09 66.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.13 -179.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 . . . . . 0 C--N 1.327 -0.402 0 CA-C-O 120.729 0.3 . . . . 0.0 110.629 178.77 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.453 -0.864 0 CA-C-O 121.016 0.34 . . . . 0.0 112.05 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -70.66 158.95 35.32 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 175.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.699 ' HG3' ' HB2' ' A' ' 94' ' ' GLN . 23.9 ptt180 -121.54 139.28 53.71 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.162 -0.615 . . . . 0.0 112.0 -176.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.59 HG23 HD13 ' A' ' 93' ' ' ILE . 85.6 m -126.1 141.13 52.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.863 -175.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.573 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 56.9 ttt180 -101.42 121.41 41.89 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.748 ' HD2' HD21 ' A' ' 55' ' ' LEU . 25.0 m-85 -115.52 130.66 56.95 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.122 0.487 . . . . 0.0 111.886 -178.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.535 ' HB2' ' HE ' ' A' ' 89' ' ' ARG . 16.5 m -112.31 136.31 51.91 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 173.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.664 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.31 146.11 22.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 110.262 -0.273 . . . . 0.0 110.262 -175.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.697 HG12 ' HB ' ' A' ' 87' ' ' ILE . 3.0 pt -140.39 143.03 30.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 176.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -99.71 128.33 45.81 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.724 0.297 . . . . 0.0 110.53 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.616 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 11.5 p -103.69 153.82 20.23 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 -178.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -76.94 -31.99 57.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.976 -177.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.405 HG22 ' N ' ' A' ' 16' ' ' GLU . 7.8 m -151.12 166.26 31.35 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.405 ' N ' HG22 ' A' ' 15' ' ' THR . 25.3 tt0 -56.98 -35.26 68.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.269 0.557 . . . . 0.0 110.262 179.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -59.96 -36.96 78.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.842 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.81 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 8.3 mm-40 -66.09 -35.76 81.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.003 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.88 -47.33 69.15 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.5 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.473 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 1.6 mptm? -55.93 -44.16 78.08 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.947 177.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.28 -33.11 74.62 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.208 0.528 . . . . 0.0 110.818 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.839 HG22 ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -76.11 -39.72 36.34 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.221 -178.416 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.754 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -72.5 -27.3 62.18 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.216 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.406 ' N ' HD12 ' A' ' 23' ' ' LEU . 31.0 t70 -59.22 -41.25 88.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.684 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.29 -47.87 25.87 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 120.867 0.365 . . . . 0.0 110.139 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.754 ' HG ' ' HA ' ' A' ' 23' ' ' LEU . 3.9 pp -67.94 -14.57 63.07 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.694 -0.403 . . . . 0.0 111.165 -178.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -71.01 -24.74 62.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.16 172.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -86.27 -32.75 20.94 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 168.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 78.84 36.64 28.17 Favored Glycine 0 N--CA 1.44 -1.047 0 CA-C-N 114.141 -1.39 . . . . 0.0 112.235 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.3 -62.31 1.99 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 119.106 -1.521 . . . . 0.0 112.191 -176.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 25.8 t0 -139.32 114.41 9.55 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 121.026 -0.27 . . . . 0.0 110.531 176.188 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.532 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 46.1 t80 -85.57 -37.34 19.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.081 0.467 . . . . 0.0 110.27 174.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.38 -33.07 69.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.863 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.65 -41.83 83.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.385 177.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.839 ' HB3' HG22 ' A' ' 22' ' ' VAL . 7.1 mt -60.14 -44.26 95.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.384 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.5 ' O ' ' HB2' ' A' ' 40' ' ' SER . . . -61.07 -48.0 83.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.651 -1.159 . . . . 0.0 111.809 -179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.7 mtpp -73.54 -42.53 61.6 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.356 -170.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -79.5 -57.9 3.46 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -169.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.81 ' HD3' ' HB3' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -101.38 -25.28 14.0 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.747 0.784 . . . . 0.0 112.662 -168.279 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.5 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 9.8 m -75.86 146.77 39.58 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.469 -172.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -80.01 2.56 23.25 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 122.033 0.92 . . . . 0.0 109.745 174.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.591 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 37.3 t70 -60.2 -16.29 31.92 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.08 -1.418 . . . . 0.0 112.382 176.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.969 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.8 pp -56.17 -16.12 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -156.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.647 ' H ' HD12 ' A' ' 44' ' ' ILE . 3.6 mp -53.39 -42.03 46.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.164 0.507 . . . . 0.0 109.963 169.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.2 m -110.15 -16.67 13.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.035 178.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.969 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -51.47 -28.21 12.61 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -176.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -53.59 -26.61 22.44 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 35.5 p30 -89.82 10.67 22.72 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.973 0.416 . . . . 0.0 110.974 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.56 24.04 27.03 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.815 -177.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 66.98 40.48 93.4 Favored Glycine 0 CA--C 1.507 -0.409 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.329 177.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.521 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 23.5 t70 -119.12 133.59 55.7 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.314 0.578 . . . . 0.0 111.353 -173.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.8 mmt -82.26 -19.88 38.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.081 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.69 -162.42 15.63 Favored Glycine 0 N--CA 1.44 -1.055 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.011 177.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.544 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 91.1 m95 -95.1 111.72 23.51 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.414 0.626 . . . . 0.0 110.906 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.894 HD13 HG12 ' A' ' 60' ' ' ILE . 2.0 pp -108.71 156.92 19.04 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.483 177.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.478 ' HB2' ' OG1' ' A' ' 59' ' ' THR . 17.6 mp0 -81.76 144.89 30.77 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -64.92 136.5 56.9 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.04 8.06 6.5 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 124.298 0.999 . . . . 0.0 112.731 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.478 ' OG1' ' HB2' ' A' ' 56' ' ' GLU . 62.2 p -111.39 6.07 20.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.093 0.949 . . . . 0.0 108.676 166.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.894 HG12 HD13 ' A' ' 55' ' ' LEU . 13.5 mt -69.47 141.02 90.32 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.381 -175.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.04 142.45 97.34 Favored 'Trans proline' 0 C--O 1.237 0.432 0 C-N-CA 122.232 1.954 . . . . 0.0 110.898 172.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.455 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 1.7 m-20 -55.04 -29.9 58.42 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.857 -169.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.537 ' HA ' ' ND2' ' A' ' 66' ' ' ASN . 35.0 tt0 -65.56 -36.41 83.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.863 0.363 . . . . 0.0 111.106 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.407 ' HB2' HG22 ' A' ' 60' ' ' ILE . 5.2 mp -83.66 -25.84 30.37 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.499 -0.48 . . . . 0.0 111.047 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.459 ' CG ' ' HB ' ' A' ' 60' ' ' ILE . 52.2 mtmt -73.86 -27.38 61.05 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 177.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . 0.537 ' ND2' ' HA ' ' A' ' 63' ' ' GLU . 3.2 p30 -84.5 -5.78 59.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.064 0.459 . . . . 0.0 110.054 176.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.987 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -68.21 -28.45 67.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.697 -178.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.39 23.05 45.26 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.979 -0.629 . . . . 0.0 113.315 176.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.634 ' HB3' ' CD1' ' A' ' 90' ' ' LEU . 11.1 mt -101.98 109.57 21.33 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.484 ' HA ' ' HD2' ' A' ' 70' ' ' LYS . 15.2 tptp -102.66 -60.1 1.6 Allowed 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 119.671 -0.812 . . . . 0.0 111.996 171.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.665 ' O ' HD13 ' A' ' 90' ' ' LEU . 25.5 mt-10 -107.81 152.03 24.94 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.268 0.556 . . . . 0.0 112.374 -169.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.719 ' HB2' HG12 ' A' ' 93' ' ' ILE . 35.6 tttp -66.4 138.31 57.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.125 -0.943 . . . . 0.0 112.207 -167.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.94 -9.62 37.1 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.875 -0.678 . . . . 0.0 111.804 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.429 ' HB3' HD12 ' A' ' 90' ' ' LEU . 9.8 tt0 -91.25 114.89 27.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.029 0.442 . . . . 0.0 109.936 175.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.597 HD12 ' HB2' ' A' ' 26' ' ' LEU . 2.4 pt? -143.12 170.08 16.38 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.963 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.687 ' HB2' HD11 ' A' ' 26' ' ' LEU . 23.7 t 78.15 45.71 0.06 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 124.164 0.915 . . . . 0.0 110.159 -172.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -92.89 104.42 3.18 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 171.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 25.4 t -90.51 113.04 25.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -176.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.731 HD11 ' HA ' ' A' ' 67' ' ' ALA . 41.1 mm -103.21 114.2 42.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.81 -176.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.564 ' HG2' ' HE1' ' A' ' 85' ' ' PHE . 4.5 tmtm? -72.02 113.43 9.04 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.108 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 35.5 t -119.05 161.45 20.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.446 -176.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.6 m -65.94 -26.39 67.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.827 177.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 35.6 m -92.79 -5.77 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.746 -178.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.66 -129.65 3.77 Favored Glycine 0 CA--C 1.508 -0.378 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 -176.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.564 ' HE1' ' HG2' ' A' ' 80' ' ' LYS . 97.0 m-85 -134.05 135.26 43.21 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.058 0.456 . . . . 0.0 110.613 177.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.664 HD11 ' HB ' ' A' ' 10' ' ' ILE . 50.5 tp -106.15 135.33 47.81 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.351 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.697 ' HB ' HG12 ' A' ' 11' ' ' ILE . 27.5 mm -105.7 118.6 53.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 178.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.987 HG11 ' HB1' ' A' ' 67' ' ' ALA . 10.7 p -103.82 136.92 34.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-O 121.319 0.581 . . . . 0.0 109.902 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.535 ' HE ' ' HB2' ' A' ' 9' ' ' SER . 2.4 tmm_? -137.74 119.13 14.73 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.286 -173.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.665 HD13 ' O ' ' A' ' 71' ' ' GLU . 8.4 mt -77.6 109.0 11.19 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.398 176.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.573 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 32.2 t70 -79.59 -54.18 6.13 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 119.824 -0.751 . . . . 0.0 111.533 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.544 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 5.0 t70 -155.5 170.11 22.71 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.164 -177.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.719 HG12 ' HB2' ' A' ' 72' ' ' LYS . 32.7 mm -135.44 128.74 48.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.384 -178.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.699 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . 47.5 mt-30 . . . . . 0 C--N 1.326 -0.444 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 172.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo . . . . . 0 C--O 1.233 0.274 0 CA-C-O 120.838 0.266 . . . . 0.0 111.723 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -69.41 157.16 37.61 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.535 ' HG2' ' HA ' ' A' ' 56' ' ' GLU . 99.9 mtt180 -130.17 151.11 51.05 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.998 0.428 . . . . 0.0 110.448 -176.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.829 HG23 HG13 ' A' ' 93' ' ' ILE . 30.7 m -136.82 137.17 39.48 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.504 -178.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.563 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 62.9 ttt180 -96.95 111.83 23.86 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.345 -0.389 . . . . 0.0 109.953 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -109.79 138.32 46.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.103 0.477 . . . . 0.0 111.308 -179.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.532 ' HB2' ' CG ' ' A' ' 89' ' ' ARG . 6.5 m -112.31 132.71 54.82 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 172.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.577 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.7 pp -137.77 144.29 31.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 110.541 -0.17 . . . . 0.0 110.541 -176.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.675 HD11 HG11 ' A' ' 22' ' ' VAL . 6.1 pt -140.43 146.95 23.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 174.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -97.66 126.57 43.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.898 0.38 . . . . 0.0 110.828 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.717 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 12.9 p -103.03 140.37 37.37 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.475 177.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -64.65 -32.2 73.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.783 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.419 HG22 ' H ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -150.9 171.71 16.82 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.54 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.665 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 33.8 tt0 -62.2 -36.25 81.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.246 0.546 . . . . 0.0 109.633 -179.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -53.89 -40.31 66.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.667 177.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.717 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 8.6 mm-40 -69.14 -41.2 77.62 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.776 -179.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.556 ' HA ' HG21 ' A' ' 13' ' ' THR . . . -59.18 -44.85 92.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.327 177.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.665 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.3 mmtp -55.89 -48.0 76.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.291 176.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.06 -33.07 73.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.108 0.48 . . . . 0.0 110.972 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.675 HG11 HD11 ' A' ' 11' ' ' ILE . 79.4 t -73.73 -50.37 29.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.25 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.8 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -68.17 -30.53 69.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.138 -176.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.477 ' O ' ' HB2' ' A' ' 27' ' ' ASN . 12.8 t70 -64.3 -41.23 96.97 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.1 0.476 . . . . 0.0 110.235 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -76.07 -39.07 56.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.186 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.813 HD13 ' HB3' ' A' ' 75' ' ' LEU . 4.1 pp -71.87 -13.87 61.79 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.159 177.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 0.5 OUTLIER -62.91 -33.14 74.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.987 172.675 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -71.92 -29.75 64.63 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 121.605 0.717 . . . . 0.0 109.371 172.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.75 29.7 46.72 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.03 -0.987 . . . . 0.0 112.334 178.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.84 -63.2 1.28 Allowed Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 119.377 -1.392 . . . . 0.0 113.326 -175.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.408 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 9.4 t0 -139.28 115.72 10.55 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 117.241 0.521 . . . . 0.0 111.86 178.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.456 ' HA ' HD12 ' A' ' 35' ' ' LEU . 73.3 t80 -84.89 -41.07 16.32 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.791 0.329 . . . . 0.0 110.816 172.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.43 -33.47 65.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.111 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.79 -44.52 85.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.091 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.456 HD12 ' HA ' ' A' ' 32' ' ' PHE . 12.9 mt -62.54 -37.26 85.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.395 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.549 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -62.52 -48.28 80.23 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.351 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.691 ' HA ' HG22 ' A' ' 43' ' ' ILE . 54.8 mtpt -79.1 -33.86 44.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.124 -173.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -79.81 -55.68 4.81 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -177.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.842 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -97.85 -24.54 15.38 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.664 0.745 . . . . 0.0 112.919 -168.303 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.549 ' HB3' ' O ' ' A' ' 36' ' ' ALA . 43.2 t -89.6 152.29 21.47 Favored 'General case' 0 C--N 1.291 -1.953 0 O-C-N 121.133 -0.979 . . . . 0.0 113.008 -167.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.38 0.93 39.65 Favored 'General case' 0 C--N 1.334 -0.069 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.102 172.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.518 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 20.2 t70 -65.07 -15.99 62.97 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.501 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 1.06 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.6 pp -55.39 -16.35 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -157.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.472 ' N ' HD12 ' A' ' 43' ' ' ILE . 77.7 mt -51.76 -43.11 33.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.258 0.551 . . . . 0.0 109.603 167.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.9 m -109.41 -25.56 10.46 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.139 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 1.06 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -50.96 -29.0 11.05 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -174.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -53.74 -24.5 15.12 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -89.4 10.65 21.76 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.033 0.445 . . . . 0.0 110.898 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.22 22.83 31.15 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.359 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.405 ' O ' ' HA ' ' A' ' 9' ' ' SER . . . 62.21 29.19 72.26 Favored Glycine 0 C--N 1.331 0.284 0 N-CA-C 111.679 -0.568 . . . . 0.0 111.679 -178.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -90.56 113.58 25.62 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.289 0.566 . . . . 0.0 111.226 -172.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 96.7 mmm -75.51 -19.22 59.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.111 177.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 100.15 -149.11 18.64 Favored Glycine 0 N--CA 1.437 -1.253 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.641 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.646 ' CZ3' ' HG2' ' A' ' 94' ' ' GLN . 86.7 m95 -109.3 111.82 23.61 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.23 0.538 . . . . 0.0 111.212 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.498 ' O ' HD12 ' A' ' 55' ' ' LEU . 1.4 pp -99.0 153.12 19.1 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.679 174.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.535 ' HA ' ' HG2' ' A' ' 5' ' ' ARG . 21.7 mt-10 -90.51 140.28 29.88 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -67.39 149.56 50.12 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.121 -178.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.32 7.42 6.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.065 -175.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.8 p -112.18 3.91 17.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.717 0.77 . . . . 0.0 109.116 167.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.511 ' HB ' ' HD3' ' A' ' 65' ' ' LYS . 22.2 mt -87.13 136.17 34.12 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.049 -169.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.53 139.47 81.9 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.265 1.977 . . . . 0.0 110.718 171.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.61 -23.86 59.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.136 -172.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -54.01 -47.58 71.34 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.161 0.288 . . . . 0.0 110.892 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 mp -83.33 -23.15 32.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.636 0.255 . . . . 0.0 111.381 -178.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.511 ' HD3' ' HB ' ' A' ' 60' ' ' ILE . 32.1 mmmt -69.83 -37.53 76.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.009 0.433 . . . . 0.0 110.22 176.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -80.19 -5.27 55.81 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.219 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.77 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -57.69 -25.13 59.86 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.856 0.36 . . . . 0.0 111.918 -179.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.86 19.9 66.72 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.313 177.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.674 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 15.3 mt -95.43 94.12 7.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.186 0.517 . . . . 0.0 111.678 -175.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -101.22 -47.84 4.59 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.936 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.46 ' O ' HD13 ' A' ' 90' ' ' LEU . 35.6 mm-40 -84.74 129.75 34.78 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.078 -171.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 92' ' ' ASP . 63.3 tttm -66.31 117.66 8.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.103 0.478 . . . . 0.0 111.073 -174.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 102.67 -1.16 48.99 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.653 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.419 ' HB3' HD12 ' A' ' 90' ' ' LEU . 8.5 tt0 -68.54 126.63 30.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.813 ' HB3' HD13 ' A' ' 26' ' ' LEU . 62.8 mt -116.54 166.08 12.5 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.819 -174.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.509 ' HB2' HD11 ' A' ' 26' ' ' LEU . 12.5 t 76.33 57.82 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.877 0.846 . . . . 0.0 111.106 168.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.443 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -102.4 103.84 2.51 Favored Glycine 0 N--CA 1.439 -1.14 0 N-CA-C 110.146 -1.182 . . . . 0.0 110.146 169.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 26.3 t -98.97 113.06 32.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.152 0.501 . . . . 0.0 109.77 -175.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.443 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 79.2 mt -102.29 116.97 46.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.86 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -86.76 127.11 34.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.357 0.599 . . . . 0.0 111.471 -177.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.5 m -128.91 155.2 45.66 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.014 174.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.4 m -59.84 -27.15 66.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.949 0.404 . . . . 0.0 111.424 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 10.0 p -87.23 -17.82 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.477 -177.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 158.86 -171.19 35.45 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.964 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -112.06 140.67 46.55 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.754 0.311 . . . . 0.0 110.904 -176.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.472 HD11 ' HB ' ' A' ' 10' ' ' ILE . 34.1 tp -113.24 135.76 53.48 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.412 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.614 ' HB ' HG12 ' A' ' 11' ' ' ILE . 24.2 mm -104.7 130.69 55.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 177.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.77 HG11 ' HB1' ' A' ' 67' ' ' ALA . 13.6 p -125.18 140.76 47.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -177.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.692 ' NH2' ' HA ' ' A' ' 91' ' ' ASP . 0.2 OUTLIER -142.14 158.7 43.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.327 0.584 . . . . 0.0 110.862 177.023 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.959 HD22 HD11 ' A' ' 93' ' ' ILE . 10.8 mt -99.95 108.86 21.18 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.479 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.692 ' HA ' ' NH2' ' A' ' 89' ' ' ARG . 19.0 t70 -81.07 -54.08 5.85 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.322 -0.551 . . . . 0.0 111.826 177.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.622 ' HA ' ' HE2' ' A' ' 72' ' ' LYS . 9.1 t70 -155.98 152.99 28.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.458 -177.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.959 HD11 HD22 ' A' ' 90' ' ' LEU . 4.7 mp -133.1 128.32 55.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.646 ' HG2' ' CZ3' ' A' ' 54' ' ' TRP . 25.4 pt20 . . . . . 0 C--N 1.327 -0.381 0 CA-C-O 121.264 0.555 . . . . 0.0 110.993 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo . . . . . 0 N--CA 1.446 -1.291 0 N-CA-C 110.509 -0.612 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.1 pt20 -71.12 148.89 46.98 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.602 ' HG3' ' HB2' ' A' ' 94' ' ' GLN . 25.0 ptt180 -122.35 129.8 52.48 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.355 0.598 . . . . 0.0 109.9 176.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.557 HG23 HG23 ' A' ' 93' ' ' ILE . 20.6 m -120.27 141.39 50.03 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.056 -0.975 . . . . 0.0 109.987 -174.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.634 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 66.0 ttt180 -95.02 111.0 22.85 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 120.071 -0.652 . . . . 0.0 109.249 177.034 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.408 ' HE2' HD13 ' A' ' 60' ' ' ILE . 15.2 m-85 -106.91 135.08 49.07 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.381 0.61 . . . . 0.0 111.239 -178.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.579 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 20.4 m -112.36 134.82 53.69 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.272 -0.876 . . . . 0.0 108.846 169.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.643 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.8 pp -139.59 143.06 31.46 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -177.125 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.732 ' HA ' ' HB2' ' A' ' 42' ' ' ASP . 1.1 pt -138.04 141.76 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -96.8 117.35 30.89 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -179.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.646 HG22 ' HE3' ' A' ' 39' ' ' LYS . 2.5 p -94.36 147.88 22.78 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.384 0.612 . . . . 0.0 110.916 -175.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.624 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 10.8 mmmm -64.77 -33.85 76.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.649 -171.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.491 HG22 ' H ' ' A' ' 16' ' ' GLU . 10.4 m -157.36 171.16 20.89 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.491 ' H ' HG22 ' A' ' 15' ' ' THR . 29.5 tt0 -57.63 -35.4 70.44 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.248 0.547 . . . . 0.0 110.323 -179.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -54.0 -43.11 69.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.497 176.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.624 ' HG3' ' HB2' ' A' ' 14' ' ' LYS . 8.1 mm-40 -64.32 -42.4 96.34 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.39 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.506 ' CB ' HD11 ' A' ' 87' ' ' ILE . . . -62.07 -46.39 89.35 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.975 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.641 ' HD3' HD21 ' A' ' 23' ' ' LEU . 30.0 mmtp -60.43 -39.67 88.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.971 178.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.19 -31.57 72.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.008 0.432 . . . . 0.0 110.871 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 18' ' ' GLU . 81.4 t -72.92 -50.58 31.69 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.865 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.641 HD21 ' HD3' ' A' ' 20' ' ' LYS . 4.2 pp -65.72 -27.64 68.47 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.336 -176.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.417 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.7 t70 -64.1 -53.52 48.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.003 0.43 . . . . 0.0 110.302 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.467 ' HG2' HD21 ' A' ' 35' ' ' LEU . 1.5 tp10 -66.37 -41.4 89.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.976 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.92 HD11 ' HB2' ' A' ' 76' ' ' SER . 3.8 pp -73.08 -16.67 61.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.012 -179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.434 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -71.38 -30.68 66.41 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 175.129 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -76.02 -32.6 59.46 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 169.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 80.62 36.37 23.14 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.518 -1.219 . . . . 0.0 113.749 168.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -85.38 -63.73 1.55 Allowed Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 118.871 -1.633 . . . . 0.0 112.404 -178.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -139.95 121.23 14.92 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.824 0.312 . . . . 0.0 110.93 173.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -84.51 -32.06 24.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.095 0.474 . . . . 0.0 110.3 174.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.65 -35.98 71.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.087 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.32 -36.22 78.98 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.353 0.597 . . . . 0.0 110.289 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.467 HD21 ' HG2' ' A' ' 25' ' ' GLU . 6.6 mt -69.56 -32.92 71.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.242 -178.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.545 ' HB2' HG21 ' A' ' 11' ' ' ILE . . . -71.23 -46.2 61.6 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.562 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.7 mtpt -77.76 -28.75 50.68 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -168.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -79.34 -61.8 1.89 Allowed 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -169.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.646 ' HE3' HG22 ' A' ' 13' ' ' THR . 0.0 OUTLIER -104.16 -21.99 13.47 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 -179.903 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.524 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 10.4 m -75.21 143.73 43.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.205 0.526 . . . . 0.0 111.53 -168.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -76.84 5.84 7.13 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.778 -177.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.732 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 18.9 t70 -64.03 -16.26 61.27 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.243 -1.344 . . . . 0.0 111.767 176.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.963 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.6 pp -55.83 -15.51 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 -159.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.43 ' N ' HD12 ' A' ' 43' ' ' ILE . 66.5 mt -58.11 -44.14 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-O 121.096 0.474 . . . . 0.0 109.849 167.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -109.65 -13.84 14.45 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.931 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.963 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -53.3 -29.07 31.46 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 122.765 0.426 . . . . 0.0 111.777 178.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -55.08 -19.4 7.23 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.513 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.9 m-20 -89.96 0.22 57.21 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.84 0.352 . . . . 0.0 110.614 177.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.47 29.31 14.37 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.131 -0.787 . . . . 0.0 111.131 -173.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.545 ' HA2' ' OD2' ' A' ' 42' ' ' ASP . . . 80.36 -2.64 76.38 Favored Glycine 0 N--CA 1.453 -0.222 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -175.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -73.86 122.23 22.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.101 0.477 . . . . 0.0 111.846 -175.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.487 ' SD ' HG12 ' A' ' 10' ' ' ILE . 87.6 mtp -78.1 -34.46 50.13 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.149 172.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 120.15 -172.14 14.8 Favored Glycine 0 N--CA 1.438 -1.19 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.186 -174.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.531 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 94.6 m95 -89.68 120.71 31.19 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 120.824 0.345 . . . . 0.0 111.078 178.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.521 HD23 ' O ' ' A' ' 55' ' ' LEU . 0.6 OUTLIER -115.7 155.37 27.85 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 174.644 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -88.5 139.57 30.34 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 120.967 0.413 . . . . 0.0 109.924 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . 0.414 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 27.9 t0 -56.96 151.32 15.02 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.337 173.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.414 ' HB3' ' O ' ' A' ' 57' ' ' ASP . . . 72.5 7.11 5.58 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 124.319 1.012 . . . . 0.0 110.943 -172.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.2 m -111.53 -0.25 16.23 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 162.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.708 ' HB ' ' HE2' ' A' ' 65' ' ' LYS . 56.6 mt -88.39 115.59 63.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.62 -176.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.26 157.66 58.87 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.166 2.577 . . . . 0.0 111.65 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.624 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . 4.7 m-20 -56.79 -20.96 25.23 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.915 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.47 -52.64 64.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.478 175.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.447 ' O ' ' HB3' ' A' ' 67' ' ' ALA . 6.3 mp -82.93 -14.23 54.54 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.929 0.395 . . . . 0.0 110.708 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.708 ' HE2' ' HB ' ' A' ' 60' ' ' ILE . 72.2 mmtt -73.3 -34.4 65.71 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 172.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 -75.15 -5.8 46.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.736 174.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.956 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -74.43 -32.25 62.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.202 175.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 73.8 21.55 79.17 Favored Glycine 0 C--N 1.336 0.529 0 CA-C-N 115.393 -0.821 . . . . 0.0 113.016 176.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.686 HD13 ' HG ' ' A' ' 90' ' ' LEU . 12.4 mt -86.41 94.64 9.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.071 0.463 . . . . 0.0 111.396 -177.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -100.29 -54.73 2.79 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.308 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.531 ' O ' HD13 ' A' ' 90' ' ' LEU . 36.8 mt-10 -106.92 142.88 35.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.12 0.486 . . . . 0.0 111.56 -172.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.571 ' CD ' ' HA ' ' A' ' 92' ' ' ASP . 28.0 ttpp -66.74 137.12 56.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.702 -168.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.1 -6.28 36.82 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.586 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.596 ' HB3' HD12 ' A' ' 90' ' ' LEU . 8.2 tt0 -91.65 116.41 28.85 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.53 0.681 . . . . 0.0 110.034 176.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.672 ' HG ' HD13 ' A' ' 26' ' ' LEU . 2.1 pt? -139.53 169.81 17.07 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.92 ' HB2' HD11 ' A' ' 26' ' ' LEU . 37.1 t 78.87 59.98 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 122.288 1.042 . . . . 0.0 109.877 -167.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -111.7 108.6 2.33 Favored Glycine 0 N--CA 1.439 -1.103 0 CA-C-N 114.192 -1.367 . . . . 0.0 109.79 168.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 37.4 t -92.11 113.6 27.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.0 0.429 . . . . 0.0 110.415 -173.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.563 HD11 ' HB2' ' A' ' 67' ' ' ALA . 71.3 mt -106.87 122.13 60.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.828 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 58.2 tttp -85.54 128.99 34.92 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.216 0.532 . . . . 0.0 110.794 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.2 m -118.66 161.51 19.96 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 174.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 26.2 t -69.58 -28.56 66.07 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.184 0.516 . . . . 0.0 109.707 176.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 10.7 p -84.33 -12.95 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.607 -177.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 157.94 -139.22 6.22 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.749 -0.738 . . . . 0.0 111.77 -177.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -131.16 149.38 52.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 117.048 0.424 . . . . 0.0 111.075 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.618 HD11 ' HB ' ' A' ' 10' ' ' ILE . 40.3 tp -121.41 135.46 55.06 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.15 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.643 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 28.9 mm -109.97 126.37 67.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.878 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.956 HG11 ' HB1' ' A' ' 67' ' ' ALA . 7.1 p -108.3 141.87 22.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 121.102 0.477 . . . . 0.0 110.497 -177.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.579 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 1.5 tmm_? -141.21 122.04 14.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.529 -175.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.686 ' HG ' HD13 ' A' ' 69' ' ' LEU . 9.8 mt -77.7 108.82 11.18 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.842 176.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.634 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 34.3 t70 -80.8 -54.17 5.84 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 119.32 -0.952 . . . . 0.0 111.54 175.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.571 ' HA ' ' CD ' ' A' ' 72' ' ' LYS . 2.7 t70 -156.47 170.69 21.74 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.71 -177.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.557 HG23 HG23 ' A' ' 6' ' ' THR . 0.4 OUTLIER -137.48 136.84 46.27 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-O 121.086 0.47 . . . . 0.0 110.976 175.827 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.602 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . 19.0 mt-30 . . . . . 0 C--N 1.322 -0.599 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.554 178.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo . . . . . 0 N--CA 1.448 -1.182 0 N-CA-C 110.841 -0.484 . . . . 0.0 110.841 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -70.03 155.44 40.59 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -113.95 138.54 50.21 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 120.622 -0.431 . . . . 0.0 109.923 -175.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.699 HG23 HG13 ' A' ' 93' ' ' ILE . 10.8 m -120.75 137.77 54.34 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.335 -178.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.418 ' HB2' ' CE2' ' A' ' 54' ' ' TRP . 67.8 ttt180 -101.85 111.96 24.41 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.712 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.642 ' HD2' HD21 ' A' ' 55' ' ' LEU . 17.7 m-85 -107.03 133.45 51.66 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.673 -177.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.536 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 2.6 m -98.28 132.54 43.68 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 168.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.72 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.24 147.04 21.75 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -177.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.757 HD11 HG11 ' A' ' 22' ' ' VAL . 3.3 pt -138.16 142.47 35.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 C-N-CA 120.423 -0.511 . . . . 0.0 109.71 177.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -97.49 115.52 27.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.094 0.473 . . . . 0.0 110.006 -177.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.43 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 77.3 p -99.01 148.93 23.5 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.398 -177.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -69.23 -34.23 74.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.77 -174.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -152.41 174.76 13.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.998 0.427 . . . . 0.0 111.923 -178.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -65.48 -26.46 67.94 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.56 -45.21 92.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.295 177.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.576 ' OE1' ' HG3' ' A' ' 39' ' ' LYS . 81.3 mm-40 -65.78 -44.86 84.49 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.635 176.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . 0.599 ' HA ' HD11 ' A' ' 87' ' ' ILE . . . -56.41 -48.04 77.76 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.427 -176.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.468 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 1.5 mptm? -64.21 -33.54 76.04 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.17 -41.5 70.27 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.085 0.469 . . . . 0.0 110.418 177.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.757 HG11 HD11 ' A' ' 11' ' ' ILE . 93.0 t -71.51 -49.17 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.368 -178.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.559 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.5 pp -63.01 -28.56 70.19 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.031 -176.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.47 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.1 t70 -65.88 -48.81 70.27 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.174 0.511 . . . . 0.0 109.952 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.464 ' HG2' HD21 ' A' ' 35' ' ' LEU . 6.6 tp10 -66.24 -43.98 85.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.679 -178.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.678 HD23 HG12 ' A' ' 22' ' ' VAL . 4.3 pp -73.43 -19.04 61.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.105 -178.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -75.0 -24.88 58.47 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.882 0.372 . . . . 0.0 110.45 176.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -71.92 -24.23 61.6 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 170.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.72 25.84 52.07 Favored Glycine 0 N--CA 1.443 -0.849 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.517 175.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.21 -63.6 1.25 Allowed Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 119.154 -1.498 . . . . 0.0 113.061 -176.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -140.07 114.81 9.47 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.255 0.528 . . . . 0.0 111.604 177.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.556 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 60.2 t80 -86.78 -41.34 14.17 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.325 0.583 . . . . 0.0 109.874 170.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.664 ' O ' ' HG2' ' A' ' 37' ' ' LYS . . . -58.61 -35.44 72.46 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.221 -176.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.04 -38.42 88.34 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.49 0.662 . . . . 0.0 110.355 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.577 ' HB3' HG13 ' A' ' 22' ' ' VAL . 11.6 mt -65.32 -36.21 83.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.301 178.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.66 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -67.41 -41.24 85.2 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.612 -1.176 . . . . 0.0 111.126 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.664 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 13.5 mmmm -69.62 -46.37 66.39 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.655 -173.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -59.35 2.75 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 -166.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.576 ' HG3' ' OE1' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -100.27 -21.87 15.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.109 -174.692 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.66 ' HB3' ' O ' ' A' ' 36' ' ' ALA . 35.4 t -69.08 146.38 52.63 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 120.839 0.352 . . . . 0.0 111.515 -171.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.41 0.1 43.62 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.837 0.827 . . . . 0.0 109.931 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.598 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 38.6 t70 -66.54 -16.07 63.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.329 -1.305 . . . . 0.0 112.428 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.987 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.8 pp -55.16 -16.61 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -150.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 65.8 mt -61.97 -39.84 85.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 118.421 0.555 . . . . 0.0 109.646 169.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m -92.2 -30.88 15.69 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.322 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.987 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -52.63 -29.53 26.63 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.335 -176.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -53.58 -30.98 44.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.044 0.449 . . . . 0.0 110.941 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -90.99 9.9 28.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.225 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.28 24.71 28.28 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.586 -177.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.462 ' HA2' ' OD2' ' A' ' 42' ' ' ASP . . . 83.86 8.44 84.28 Favored Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 -176.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -72.34 108.74 5.62 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.214 0.531 . . . . 0.0 111.39 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 54.2 mmm -82.48 -24.06 34.39 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.753 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 130.07 -160.36 22.9 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.036 -175.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.652 ' CH2' ' HG2' ' A' ' 94' ' ' GLN . 81.0 m95 -107.72 138.52 43.8 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.886 0.374 . . . . 0.0 110.993 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.642 HD21 ' HD2' ' A' ' 8' ' ' TYR . 3.5 pp -126.24 156.18 40.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.208 176.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -82.2 130.51 35.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.077 0.465 . . . . 0.0 110.455 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -70.29 147.05 50.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.165 178.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 71.65 7.24 5.91 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 124.34 1.025 . . . . 0.0 111.788 -176.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.1 p -111.7 2.1 17.04 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 166.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.596 ' HB ' ' HE3' ' A' ' 65' ' ' LYS . 45.6 mt -69.72 128.46 91.97 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 114.215 -1.357 . . . . 0.0 111.257 -173.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.98 157.01 61.57 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 122.833 2.356 . . . . 0.0 111.445 174.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.525 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . 7.4 p-10 -56.68 -21.37 27.19 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.601 -172.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.728 ' HG3' HG21 ' A' ' 79' ' ' ILE . 39.4 tt0 -56.29 -56.59 19.22 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.087 0.242 . . . . 0.0 110.614 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.406 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 4.8 mp -83.72 -16.62 44.2 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.504 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.596 ' HE3' ' HB ' ' A' ' 60' ' ' ILE . 31.8 mmtp -60.13 -35.29 74.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.217 0.532 . . . . 0.0 110.435 174.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -78.3 -5.82 53.22 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.772 -178.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.79 -32.24 46.31 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.195 0.521 . . . . 0.0 110.419 177.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 68.98 22.09 75.67 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.326 -0.852 . . . . 0.0 113.339 176.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.709 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 6.6 mt -86.81 88.49 7.69 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.004 0.43 . . . . 0.0 111.707 -174.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.421 ' HA ' ' HD2' ' A' ' 70' ' ' LYS . 23.1 tptp -100.58 -39.98 7.63 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 178.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -95.94 128.35 42.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.955 -174.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.635 ' HB2' HD13 ' A' ' 93' ' ' ILE . 82.6 tttt -66.58 134.73 52.95 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.151 0.501 . . . . 0.0 111.044 -172.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.13 -1.63 35.28 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.538 -177.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -92.16 130.77 37.8 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.166 0.507 . . . . 0.0 110.554 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.533 ' HB3' HD13 ' A' ' 26' ' ' LEU . 2.1 mp -118.82 169.77 9.57 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.691 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.2 t 78.98 60.95 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.797 0.808 . . . . 0.0 112.593 169.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -109.21 102.84 1.7 Allowed Glycine 0 N--CA 1.443 -0.849 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 163.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.406 HG21 HD23 ' A' ' 23' ' ' LEU . 19.9 t -100.46 113.88 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.482 0 CA-C-O 121.004 0.43 . . . . 0.0 110.007 -177.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.728 HG21 ' HG3' ' A' ' 63' ' ' GLU . 51.5 mm -109.62 127.01 66.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.7 -177.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -77.6 125.31 29.14 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.379 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.0 m -119.9 163.79 17.02 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.029 178.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.2 m -68.91 -26.4 65.07 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.25 0.548 . . . . 0.0 110.262 177.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 14.7 p -84.1 -12.54 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.238 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.7 -133.06 4.14 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.007 -0.616 . . . . 0.0 111.786 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -130.1 139.41 50.94 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.658 0.265 . . . . 0.0 110.511 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.72 HD11 ' HB ' ' A' ' 10' ' ' ILE . 29.9 tp -120.48 135.67 54.99 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -178.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.599 HD11 ' HA ' ' A' ' 19' ' ' ALA . 5.0 mt -119.23 125.88 74.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.541 HG23 HD12 ' A' ' 69' ' ' LEU . 1.8 m -113.16 145.9 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-O 121.486 0.66 . . . . 0.0 111.311 -174.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.556 ' HD3' ' CG ' ' A' ' 32' ' ' PHE . 34.3 ttp180 -134.58 145.86 49.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.196 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.864 HD22 HD11 ' A' ' 93' ' ' ILE . 14.6 mt -87.42 108.29 18.94 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.079 0.466 . . . . 0.0 111.284 179.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.482 ' O ' ' HE3' ' A' ' 72' ' ' LYS . 3.7 t0 -80.92 -53.76 6.17 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.897 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.409 ' C ' HD12 ' A' ' 93' ' ' ILE . 10.8 m-20 -154.51 160.36 41.51 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.113 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.864 HD11 HD22 ' A' ' 90' ' ' LEU . 3.4 mp -136.05 127.69 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 172.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.652 ' HG2' ' CH2' ' A' ' 54' ' ' TRP . 81.6 mm-40 . . . . . 0 C--N 1.331 -0.226 0 CA-C-O 120.768 0.318 . . . . 0.0 110.36 177.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo . . . . . 0 N--CA 1.447 -1.258 0 CA-C-O 120.797 0.249 . . . . 0.0 111.73 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 -70.81 158.12 36.9 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 176.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -121.99 135.0 54.81 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 120.033 -0.667 . . . . 0.0 110.389 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.731 HG23 HG13 ' A' ' 93' ' ' ILE . 22.3 m -128.67 133.59 48.26 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.311 -177.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.633 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 34.1 ttt180 -95.44 111.47 23.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.646 ' HD2' HD21 ' A' ' 55' ' ' LEU . 14.7 m-85 -103.96 135.4 45.55 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.283 -178.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.669 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 0.7 OUTLIER -96.33 132.18 42.09 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 168.588 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.87 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.7 141.38 27.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.628 HG12 ' HB ' ' A' ' 87' ' ' ILE . 5.6 pt -140.49 149.15 21.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -103.27 113.32 26.72 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.496 -174.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.81 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 16.1 p -94.66 141.83 28.16 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.261 178.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -64.55 -30.78 71.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.782 -174.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.31 173.67 14.21 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.511 ' HG2' ' HE2' ' A' ' 20' ' ' LYS . 32.2 tt0 -64.13 -36.58 84.5 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -53.05 -39.54 63.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.979 177.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.81 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 6.1 mm-40 -67.38 -37.1 82.61 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.776 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.83 -39.52 94.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.088 179.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.511 ' HE2' ' HG2' ' A' ' 16' ' ' GLU . 5.1 mptp? -55.55 -48.41 74.78 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.098 176.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.13 -31.05 72.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.961 0.41 . . . . 0.0 111.126 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.513 HG11 HD11 ' A' ' 11' ' ' ILE . 94.4 t -75.68 -51.91 19.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.074 179.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.459 HD12 ' N ' ' A' ' 24' ' ' ASP . 4.6 pp -66.64 -27.78 67.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.252 -176.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.459 ' N ' HD12 ' A' ' 23' ' ' LEU . 28.1 t70 -64.26 -46.72 82.49 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.759 0.314 . . . . 0.0 111.209 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.456 ' HB3' HD21 ' A' ' 35' ' ' LEU . 29.9 tt0 -75.35 -40.15 58.5 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.29 -176.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 75' ' ' LEU . 2.8 pp -69.96 -13.66 62.34 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.661 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.452 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -69.5 -21.03 63.71 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.95 174.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -88.99 -26.19 21.62 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 169.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.74 33.93 26.17 Favored Glycine 0 N--CA 1.449 -0.496 0 CA-C-N 114.609 -1.178 . . . . 0.0 113.397 170.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.67 -63.41 1.48 Allowed Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 119.025 -1.559 . . . . 0.0 112.839 -176.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.521 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 3.0 m-20 -139.48 116.65 11.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.883 0.342 . . . . 0.0 111.613 177.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.526 ' HA ' HD12 ' A' ' 35' ' ' LEU . 43.3 t80 -81.71 -37.87 26.66 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 169.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.49 -37.72 65.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.834 176.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.72 -39.13 84.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.581 -178.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.526 HD12 ' HA ' ' A' ' 32' ' ' PHE . 11.4 mt -66.99 -43.04 83.99 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.196 177.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . 0.428 ' CB ' HG21 ' A' ' 11' ' ' ILE . . . -59.28 -53.29 59.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.394 -1.276 . . . . 0.0 111.892 -177.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.497 ' HA ' HG22 ' A' ' 43' ' ' ILE . 40.2 mtpt -75.66 -29.5 59.1 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.906 -169.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -79.92 -56.03 4.55 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.813 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 1.2 tppp? -97.66 -24.74 15.37 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -163.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.625 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 24.7 p -92.17 156.56 17.25 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.024 -1.048 . . . . 0.0 112.387 -165.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.98 6.07 19.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.335 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.466 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 13.1 t70 -75.27 -15.24 60.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.051 -0.977 . . . . 0.0 112.218 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 1.033 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.7 pp -55.8 -15.98 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -152.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.477 ' N ' HD12 ' A' ' 43' ' ' ILE . 58.3 mt -53.93 -37.56 34.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 118.427 0.558 . . . . 0.0 109.748 169.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 p -107.72 -25.09 11.45 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.483 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 1.033 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -56.65 -29.21 62.01 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 178.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 43' ' ' ILE . 99.2 mtt180 -57.87 -15.84 9.88 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.866 0.365 . . . . 0.0 111.524 176.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASN . . . . . 0.452 HD22 ' HB2' ' A' ' 51' ' ' ASP . 11.6 t30 -89.65 10.73 22.08 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.654 0.74 . . . . 0.0 109.866 176.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.54 10.19 62.17 Favored Glycine 0 N--CA 1.453 -0.187 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.074 -177.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.431 ' HA2' ' HA ' ' A' ' 46' ' ' ALA . . . 96.57 -13.5 65.36 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.109 177.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASP . . . . . 0.539 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 47.6 m-20 -72.95 114.4 11.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.504 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 27.0 ptm -71.93 -21.81 61.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.899 -177.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 132.23 -159.62 23.4 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.86 -179.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.432 ' CH2' ' HG3' ' A' ' 94' ' ' GLN . 86.1 m95 -109.04 117.02 33.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.82 0.343 . . . . 0.0 110.633 -179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.646 HD21 ' HD2' ' A' ' 8' ' ' TYR . 2.0 pp -103.66 151.81 22.53 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.79 174.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -92.39 136.77 32.92 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.103 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -57.04 147.99 22.8 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.144 177.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.73 6.99 6.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.263 -0.881 . . . . 0.0 112.383 -178.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 p -111.81 7.45 20.18 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 163.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.646 ' HB ' ' HE3' ' A' ' 65' ' ' LYS . 36.1 mt -86.24 127.25 62.17 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.633 -174.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -65.91 151.74 83.31 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.445 2.096 . . . . 0.0 111.396 174.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.412 ' HA ' ' CG ' ' A' ' 65' ' ' LYS . 5.2 p-10 -59.34 -17.88 33.42 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.349 -176.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -64.04 -47.28 80.81 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.778 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.8 mp -83.4 -15.06 51.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.825 0.345 . . . . 0.0 110.659 177.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.646 ' HE3' ' HB ' ' A' ' 60' ' ' ILE . 33.2 mmtp -63.34 -30.51 71.63 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.487 0.66 . . . . 0.0 109.764 173.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -74.0 -11.52 60.36 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.263 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.551 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -70.49 -31.35 68.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.1 0.476 . . . . 0.0 111.151 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.47 19.3 64.43 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.751 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.713 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 18.6 mt -85.34 90.9 8.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.048 0.451 . . . . 0.0 111.142 -176.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -100.41 -43.49 6.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.66 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -107.64 135.31 49.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.764 0.316 . . . . 0.0 110.905 -174.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . 0.605 ' HD3' ' HA ' ' A' ' 92' ' ' ASP . 6.7 ttpm? -66.58 138.97 57.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.767 -171.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.39 -5.19 35.42 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -94.19 128.49 40.66 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.231 0.538 . . . . 0.0 110.035 177.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 26' ' ' LEU . 1.2 pp -145.14 170.91 15.31 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.902 -175.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.62 ' HB2' ' CD1' ' A' ' 26' ' ' LEU . 25.6 t 79.25 49.71 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.425 1.078 . . . . 0.0 110.809 -174.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.421 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -98.72 110.73 4.07 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 168.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.29 113.36 39.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -176.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.562 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 47.5 mm -97.0 114.84 34.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.478 -175.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.773 ' HG2' ' CE2' ' A' ' 85' ' ' PHE . 2.4 tmtp? -83.62 113.92 21.18 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.166 -174.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.7 m -122.93 167.41 13.61 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.134 176.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.5 t -84.59 -26.32 28.02 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 32.9 m -77.78 -10.45 13.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.241 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 149.24 -159.38 28.03 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.416 -0.674 . . . . 0.0 111.416 -179.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' PHE . . . . . 0.773 ' CE2' ' HG2' ' A' ' 80' ' ' LYS . 91.1 m-85 -125.66 132.5 52.42 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.848 0.356 . . . . 0.0 110.513 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.87 HD11 ' HB ' ' A' ' 10' ' ' ILE . 41.6 tp -107.19 135.37 48.84 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.147 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.663 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 22.4 mm -108.1 124.14 64.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.581 HG22 HD12 ' A' ' 69' ' ' LEU . 12.1 p -113.51 139.5 38.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.355 0.597 . . . . 0.0 111.232 -175.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.669 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 7.5 ttp180 -136.49 148.0 47.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.815 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.713 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.9 mt -94.72 109.42 21.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.619 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.633 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 37.1 t70 -80.46 -55.05 5.15 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 119.942 -0.703 . . . . 0.0 111.58 175.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . 0.605 ' HA ' ' HD3' ' A' ' 72' ' ' LYS . 35.9 t70 -157.13 160.21 38.59 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.62 0.248 . . . . 0.0 111.232 177.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.731 HG13 HG23 ' A' ' 6' ' ' THR . 3.8 mp -124.73 127.1 72.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 172.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . 0.432 ' HG3' ' CH2' ' A' ' 54' ' ' TRP . 20.9 mt-30 . . . . . 0 C--N 1.327 -0.408 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -176.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.6 m . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 121.07 0.462 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.548 ' HB2' ' HD2' ' A' ' 3' ' ' PRO . 17.5 pt20 -145.73 168.36 12.02 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 -178.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.548 ' HD2' ' HB2' ' A' ' 2' ' ' GLN . 73.2 Cg_endo -79.65 133.59 10.51 Favored 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 122.694 2.263 . . . . 0.0 113.429 -175.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.492 ' HG3' ' HB2' ' A' ' 57' ' ' ASP . 13.1 pt20 -70.74 160.15 33.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.249 -0.887 . . . . 0.0 109.323 172.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.483 ' HB2' ' CG ' ' A' ' 94' ' ' GLN . 99.3 mtt180 -122.59 151.18 41.68 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.995 0.426 . . . . 0.0 111.024 -177.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.659 HG23 HD13 ' A' ' 93' ' ' ILE . 32.2 m -135.19 136.04 41.49 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.516 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.632 ' HD3' ' OD1' ' A' ' 91' ' ' ASP . 63.3 ttt180 -100.84 111.39 23.6 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.793 ' HD2' HD21 ' A' ' 55' ' ' LEU . 19.5 m-85 -106.84 141.06 38.67 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.742 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.498 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 14.7 m -112.84 131.95 55.49 Favored 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 169.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.615 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.7 pp -142.59 141.58 27.56 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 N-CA-C 110.369 -0.234 . . . . 0.0 110.369 -173.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.706 HD11 HG11 ' A' ' 22' ' ' VAL . 10.5 pt -140.42 144.87 26.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -103.37 128.97 50.33 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.924 0.392 . . . . 0.0 110.743 -176.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.725 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 10.9 p -109.0 156.21 20.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.186 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.502 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 71.9 mmtt -65.62 -49.1 69.94 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.379 -179.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -136.99 175.61 9.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.557 -177.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.684 ' HG2' ' HD3' ' A' ' 20' ' ' LYS . 26.7 tt0 -63.4 -31.32 72.44 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 176.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -56.62 -45.66 81.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 114.942 -1.026 . . . . 0.0 110.363 176.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.725 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 8.4 mm-40 -65.5 -43.01 91.49 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.97 179.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -59.82 -47.43 85.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.915 178.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.684 ' HD3' ' HG2' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -56.63 -40.85 76.11 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 175.639 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.92 -37.55 87.8 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.125 0.488 . . . . 0.0 110.689 177.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.706 HG11 HD11 ' A' ' 11' ' ' ILE . 73.5 t -71.59 -48.23 53.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.371 -179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.715 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -70.74 -27.85 64.27 Favored 'General case' 0 N--CA 1.451 -0.42 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.324 -176.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -61.79 -43.61 98.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.079 0.466 . . . . 0.0 110.16 177.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.447 ' HG2' HD21 ' A' ' 35' ' ' LEU . 7.5 tp10 -69.66 -46.2 66.68 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.642 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.842 HD13 HD13 ' A' ' 75' ' ' LEU . 3.5 pp -73.0 -13.91 61.32 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 121.034 -0.266 . . . . 0.0 111.457 -178.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.422 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -66.65 -28.2 68.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.188 0.518 . . . . 0.0 110.125 175.517 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -74.92 -32.19 61.73 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 170.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.14 36.11 13.64 Favored Glycine 0 N--CA 1.444 -0.776 0 CA-C-N 114.555 -1.202 . . . . 0.0 113.24 171.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.79 -64.16 1.26 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 118.877 -1.63 . . . . 0.0 112.741 -178.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 39.6 t0 -140.31 122.6 15.91 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.904 174.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.619 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 59.3 t80 -84.5 -38.13 20.46 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.008 0.432 . . . . 0.0 110.232 171.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.58 -38.41 66.66 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.838 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.49 ' O ' ' HG3' ' A' ' 38' ' ' GLU . . . -64.75 -42.85 94.84 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.504 0.669 . . . . 0.0 110.418 -178.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.447 HD21 ' HG2' ' A' ' 25' ' ' GLU . 9.8 mt -64.07 -36.44 84.0 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.448 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.595 ' HA ' HG21 ' A' ' 11' ' ' ILE . . . -63.29 -43.85 96.73 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.309 -1.314 . . . . 0.0 112.174 -176.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.404 ' HG3' ' HA ' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -77.5 -30.17 52.86 Favored 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.5 -0.48 . . . . 0.0 111.945 -173.772 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.49 ' HG3' ' O ' ' A' ' 34' ' ' ALA . 43.6 mt-10 -79.39 -57.81 3.52 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -170.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.589 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -99.32 -26.44 14.16 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.655 0.74 . . . . 0.0 112.276 -171.266 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.578 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 37.1 t -67.65 137.56 55.68 Favored 'General case' 0 C--N 1.3 -1.587 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -170.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.25 1.03 38.61 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.662 171.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.461 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 24.9 t70 -69.85 -14.87 62.96 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.952 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 1.05 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.3 pp -54.6 -14.72 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.535 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -155.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.889 ' H ' HD12 ' A' ' 44' ' ' ILE . 3.6 mp -51.18 -37.9 18.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 167.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.8 m -109.92 -32.93 6.87 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.816 174.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 1.05 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -54.58 -29.26 50.95 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.788 0.662 . . . . 0.0 112.788 -178.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.547 ' HG3' ' O ' ' A' ' 43' ' ' ILE . 80.4 mtp180 -59.34 -15.1 14.24 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 117.718 0.236 . . . . 0.0 111.44 178.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 67.3 m-20 -83.69 9.64 11.2 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.974 0.416 . . . . 0.0 110.536 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.1 26.17 22.35 Favored Glycine 0 N--CA 1.45 -0.403 0 N-CA-C 111.605 -0.598 . . . . 0.0 111.605 -176.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 83.64 -8.06 66.97 Favored Glycine 0 C--N 1.329 0.181 0 N-CA-C 112.061 -0.416 . . . . 0.0 112.061 -179.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -73.26 116.22 13.55 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.889 0.376 . . . . 0.0 111.184 -177.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.584 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 26.0 ptm -82.24 -19.38 39.76 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.697 176.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 118.24 177.0 17.0 Favored Glycine 0 N--CA 1.445 -0.745 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.957 -179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.568 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 72.2 m95 -84.37 114.68 22.05 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.682 0.277 . . . . 0.0 110.781 177.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.793 HD21 ' HD2' ' A' ' 8' ' ' TYR . 3.1 pp -98.01 155.72 16.97 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.048 -0.524 . . . . 0.0 109.594 175.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.43 ' HG2' ' HG2' ' A' ' 5' ' ' ARG . 35.5 mt-10 -96.63 145.33 25.85 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 179.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.492 ' HB2' ' HG3' ' A' ' 4' ' ' GLN . 13.8 t70 -65.13 141.2 58.78 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -176.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 72.14 9.22 5.97 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.083 -0.962 . . . . 0.0 112.335 -177.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 15.8 p -110.45 -0.1 17.6 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 167.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.715 HG12 HD13 ' A' ' 55' ' ' LEU . 25.0 mt -71.55 129.87 88.09 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.945 -176.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.446 ' HG2' HD13 ' A' ' 64' ' ' LEU . 30.1 Cg_endo -65.03 148.89 89.82 Favored 'Trans proline' 0 C--O 1.236 0.419 0 C-N-CA 122.487 2.125 . . . . 0.0 111.169 173.042 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.678 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 0.8 OUTLIER -56.43 -25.24 49.75 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.462 -175.121 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -57.21 -49.74 75.05 Favored 'General case' 0 C--N 1.319 -0.743 0 O-C-N 123.41 0.444 . . . . 0.0 110.51 177.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.446 HD13 ' HG2' ' A' ' 61' ' ' PRO . 6.0 mp -83.42 -15.29 50.27 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 111.594 0.22 . . . . 0.0 111.594 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.678 ' HD2' ' HA ' ' A' ' 62' ' ' ASP . 97.3 mttt -61.48 -31.97 71.97 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.449 0.642 . . . . 0.0 109.879 174.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -83.53 -5.37 59.15 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.6 -178.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.759 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -69.08 -32.01 71.15 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.007 0.432 . . . . 0.0 111.598 -178.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 70.19 17.7 74.23 Favored Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.751 -0.659 . . . . 0.0 113.477 174.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.709 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 15.3 mt -91.68 84.49 5.46 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -176.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.459 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 40.4 mmtm -102.73 -22.77 13.88 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 174.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -94.07 120.24 34.05 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.475 0.178 . . . . 0.0 111.157 -178.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 48.6 tttp -66.42 130.15 42.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.039 0.447 . . . . 0.0 111.452 -171.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.27 -12.49 40.19 Favored Glycine 0 N--CA 1.446 -0.662 0 N-CA-C 111.224 -0.751 . . . . 0.0 111.224 -179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -78.23 122.29 25.5 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.106 0.479 . . . . 0.0 110.227 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.842 HD13 HD13 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -133.01 169.59 16.61 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.525 -179.673 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.697 ' HB2' HD11 ' A' ' 26' ' ' LEU . 23.1 t 77.99 53.24 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 O-C-N 124.178 0.924 . . . . 0.0 110.297 -174.726 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -101.11 108.77 3.5 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 110.227 -1.149 . . . . 0.0 110.227 170.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 21.2 t -99.17 113.72 34.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.144 0.497 . . . . 0.0 109.972 -176.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.472 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 69.2 mt -98.93 115.29 39.09 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.071 -178.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.576 ' HG2' ' HE2' ' A' ' 85' ' ' PHE . 1.5 tmtp? -81.19 113.66 19.49 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.905 -175.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.0 t -125.78 160.84 28.76 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 176.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 12.2 t -74.4 -26.28 59.99 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.156 0.503 . . . . 0.0 109.893 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 25.8 m -79.65 -10.12 12.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.988 -179.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.16 -163.99 27.32 Favored Glycine 0 N--CA 1.446 -0.675 0 N-CA-C 111.099 -0.8 . . . . 0.0 111.099 -178.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.576 ' HE2' ' HG2' ' A' ' 80' ' ' LYS . 96.7 m-85 -116.39 129.53 56.29 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.061 0.458 . . . . 0.0 110.892 -176.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.602 HD11 ' HB ' ' A' ' 10' ' ' ILE . 48.4 tp -103.93 135.06 46.16 Favored 'General case' 0 N--CA 1.443 -0.786 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.875 -178.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.615 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 22.4 mm -107.64 121.4 60.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 178.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.759 HG11 ' HB1' ' A' ' 67' ' ' ALA . 14.8 p -110.5 137.48 42.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 CA-C-O 121.206 0.527 . . . . 0.0 111.024 -176.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.778 ' HG3' ' HB3' ' A' ' 75' ' ' LEU . 7.0 ttp180 -132.14 144.61 50.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.485 -0.78 . . . . 0.0 109.975 178.223 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.709 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 10.6 mt -93.22 110.47 21.98 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.359 177.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.632 ' OD1' ' HD3' ' A' ' 7' ' ' ARG . 17.5 t70 -79.06 -54.33 6.12 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.812 177.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.568 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 6.5 t70 -156.17 165.91 35.0 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.713 0.292 . . . . 0.0 111.529 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.659 HD13 HG23 ' A' ' 6' ' ' THR . 32.9 mm -130.81 128.98 63.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.778 -0.647 . . . . 0.0 109.409 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.483 ' CG ' ' HB2' ' A' ' 5' ' ' ARG . 10.5 pt20 -130.28 131.82 45.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.078 0.466 . . . . 0.0 110.375 176.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -88.72 54.3 2.98 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.238 177.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 72.01 -66.55 0.3 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.366 177.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.752 ' HA ' ' HB2' ' A' ' 102' ' ' HIS . 31.3 t60 -63.2 -27.12 69.14 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -173.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . 0.417 ' HB3' ' HB2' ' A' ' 94' ' ' GLN . 6.1 t-80 -68.72 95.3 0.65 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -169.336 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -179.76 -64.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 174.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 30.1 t60 -149.02 -59.65 0.22 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.073 -0.967 . . . . 0.0 108.551 174.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 31.4 t60 -162.99 114.23 1.48 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.354 172.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.752 ' HB2' ' HA ' ' A' ' 97' ' ' HIS . 73.5 m-70 . . . . . 0 C--O 1.248 0.991 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 168.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 8.6 t . . . . . 0 N--CA 1.479 0.991 0 CA-C-O 120.889 0.376 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -119.03 135.61 23.91 Favored Pre-proline 0 N--CA 1.45 -0.465 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 177.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -85.46 145.63 9.42 Favored 'Trans proline' 0 N--CA 1.454 -0.829 0 C-N-CA 122.728 2.285 . . . . 0.0 112.108 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.643 ' CB ' ' HA ' ' A' ' 95' ' ' ALA . 13.8 pt20 -70.35 158.83 35.24 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 175.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.505 ' HG2' ' HA ' ' A' ' 56' ' ' GLU . 99.4 mtt180 -128.28 148.28 50.64 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.305 0.574 . . . . 0.0 111.596 -170.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.647 HG23 HD13 ' A' ' 93' ' ' ILE . 69.8 m -123.16 136.13 54.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.518 -177.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.422 ' HB2' ' CE2' ' A' ' 54' ' ' TRP . 68.5 ttt180 -99.93 111.69 23.99 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.757 ' HD2' HD21 ' A' ' 55' ' ' LEU . 12.4 m-85 -104.61 138.33 41.11 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.366 0.603 . . . . 0.0 111.549 -178.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.732 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 19.4 m -111.56 133.41 53.85 Favored 'General case' 0 C--N 1.316 -0.853 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 170.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.665 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.33 145.68 23.35 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.23 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.04 -174.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.68 HG12 ' HB ' ' A' ' 87' ' ' ILE . 3.3 pt -139.75 148.18 23.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 176.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -99.65 112.63 24.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.914 0.387 . . . . 0.0 110.667 -176.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 21.7 p -96.12 144.84 26.0 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.186 176.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -84.88 -21.36 29.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.997 -169.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.485 ' O ' ' HB2' ' A' ' 18' ' ' GLU . 4.1 m -147.65 164.57 33.11 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 176.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.571 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 26.9 tt0 -69.71 -27.28 64.86 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 177.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.17 -39.47 82.61 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.477 172.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.619 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 5.8 mm-40 -64.23 -41.09 97.16 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.935 -1.029 . . . . 0.0 110.165 175.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.57 ' O ' ' HG ' ' A' ' 23' ' ' LEU . . . -63.18 -47.29 83.22 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.669 179.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.571 ' HG2' ' O ' ' A' ' 16' ' ' GLU . 74.4 mmtt -55.01 -44.11 74.25 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.156 0.503 . . . . 0.0 110.789 178.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -70.99 -37.07 72.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.151 -179.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.612 HG22 ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -76.2 -38.38 33.93 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.554 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.745 -175.416 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 19' ' ' ALA . 4.2 pp -72.61 -28.42 62.77 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 121.104 -0.239 . . . . 0.0 111.279 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.524 ' N ' HD12 ' A' ' 23' ' ' LEU . 30.3 t70 -58.01 -41.12 82.45 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.674 0.274 . . . . 0.0 111.553 -176.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.672 ' HB3' HD21 ' A' ' 35' ' ' LEU . 0.7 OUTLIER -71.37 -44.04 65.77 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.104 0.478 . . . . 0.0 109.855 -179.367 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.593 ' HB3' ' CD1' ' A' ' 35' ' ' LEU . 3.8 pp -73.16 -16.94 61.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.674 -178.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.89 -25.01 60.92 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-O 121.235 0.54 . . . . 0.0 109.667 172.415 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -84.96 -24.55 28.27 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.918 0.866 . . . . 0.0 108.784 170.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 75.03 39.91 36.45 Favored Glycine 0 N--CA 1.439 -1.165 0 CA-C-N 114.104 -1.407 . . . . 0.0 112.486 175.293 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.47 -64.46 1.44 Allowed Glycine 0 N--CA 1.442 -0.91 0 C-N-CA 118.526 -1.797 . . . . 0.0 112.512 -178.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.479 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 45.3 t0 -141.8 114.98 8.79 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 117.142 0.471 . . . . 0.0 111.127 170.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.631 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 32.8 t80 -77.47 -31.98 54.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.107 0.48 . . . . 0.0 109.747 173.687 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.475 ' HB1' ' HA2' ' A' ' 49' ' ' GLY . . . -64.62 -31.64 72.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.712 -179.297 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.65 -40.85 84.52 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.357 0.599 . . . . 0.0 109.944 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.672 HD21 ' HB3' ' A' ' 25' ' ' GLU . 14.0 mt -62.25 -44.89 95.51 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.458 178.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.533 ' O ' ' HB2' ' A' ' 40' ' ' SER . . . -56.99 -47.48 80.69 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 114.592 -1.185 . . . . 0.0 111.529 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.525 ' HG2' ' HA ' ' A' ' 47' ' ' ARG . 39.4 mtpt -79.89 -32.99 40.3 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.153 -172.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -80.36 -60.7 2.22 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -169.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.619 ' HD3' ' HB3' ' A' ' 18' ' ' GLU . 1.1 ttmm -103.11 -25.05 13.54 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.984 0.897 . . . . 0.0 112.813 -170.612 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.564 ' O ' HG23 ' A' ' 43' ' ' ILE . 7.5 m -75.31 143.34 42.98 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.519 -169.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -79.19 1.61 23.96 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.611 0.719 . . . . 0.0 110.24 177.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.568 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 27.8 t70 -65.82 -16.65 64.01 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.671 -1.15 . . . . 0.0 111.395 176.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 1.014 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 3.5 pt -56.21 -17.88 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 114.579 1.325 . . . . 0.0 114.579 -157.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 71.0 mt -51.74 -39.8 25.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 121.268 0.556 . . . . 0.0 110.014 167.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 35.4 t -112.41 -28.96 7.68 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.345 178.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 1.014 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -51.71 -29.36 18.09 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -175.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.525 ' HA ' ' HG2' ' A' ' 37' ' ' LYS . 89.8 mtt180 -63.71 -8.84 11.44 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.8 p30 -90.38 10.32 25.49 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.958 0.409 . . . . 0.0 110.991 170.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.475 ' HA2' ' HB1' ' A' ' 33' ' ' ALA . . . 92.26 26.51 18.24 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 116.141 -0.482 . . . . 0.0 112.976 -176.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.42 20.06 79.79 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 121.62 -0.324 . . . . 0.0 113.364 173.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -97.0 122.94 40.54 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.014 0.435 . . . . 0.0 111.033 -176.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.548 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 27.0 ptm -82.68 -19.67 37.67 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.834 176.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 113.69 -171.22 13.69 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.0 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.535 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 84.4 m95 -90.68 125.47 35.67 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.004 0.43 . . . . 0.0 111.143 179.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.757 HD21 ' HD2' ' A' ' 8' ' ' TYR . 2.7 pp -115.33 156.51 25.36 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 173.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.516 ' O ' ' HB ' ' A' ' 59' ' ' THR . 25.3 mt-10 -81.67 132.26 35.29 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.964 0.412 . . . . 0.0 110.092 -177.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.62 ' HB3' ' HG3' ' A' ' 4' ' ' GLN . 31.9 t70 -73.22 145.32 46.32 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.277 -175.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 62.9 7.56 2.69 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.422 -172.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' ' 56' ' ' GLU . 13.6 m -112.11 3.01 17.03 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.978 -1.119 . . . . 0.0 107.978 172.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.701 HG12 HD13 ' A' ' 55' ' ' LEU . 21.8 mt -73.59 133.59 79.88 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-N 113.835 -1.53 . . . . 0.0 110.865 -173.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -61.75 155.61 53.11 Favored 'Trans proline' 0 C--O 1.236 0.41 0 C-N-CA 122.801 2.334 . . . . 0.0 111.839 174.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.664 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 8.9 m-20 -55.54 -27.51 49.31 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.048 -0.978 . . . . 0.0 112.708 -171.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.97 -55.49 32.06 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.936 178.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.514 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 5.2 mp -83.45 -16.59 45.16 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.532 -177.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.664 ' HD2' ' HA ' ' A' ' 62' ' ' ASP . 67.6 mttm -56.86 -44.12 81.85 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.602 0.715 . . . . 0.0 109.602 172.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 -75.67 -5.34 45.09 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.017 -176.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.838 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -71.33 -31.09 66.97 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.037 0.446 . . . . 0.0 111.049 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 77.48 19.08 76.92 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.935 175.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.717 HD12 HG22 ' A' ' 88' ' ' VAL . 11.8 mt -96.11 87.26 4.49 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.839 0.352 . . . . 0.0 111.309 -177.465 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.6 tptp -100.69 -41.44 6.91 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -177.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.513 ' O ' HD13 ' A' ' 90' ' ' LEU . 31.5 tt0 -100.32 135.33 41.91 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.853 0.358 . . . . 0.0 111.351 -174.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.477 ' HE3' ' O ' ' A' ' 91' ' ' ASP . 1.6 tmtp? -66.48 135.39 54.18 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.522 -170.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.58 -11.96 39.08 Favored Glycine 0 N--CA 1.45 -0.386 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.495 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.513 ' HB3' HD12 ' A' ' 90' ' ' LEU . 10.1 tt0 -83.9 127.8 34.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.159 0.504 . . . . 0.0 110.705 -178.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.586 HD13 HD12 ' A' ' 26' ' ' LEU . 1.4 pp -138.27 170.3 16.27 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.345 -178.305 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.9 t 78.64 60.37 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 124.106 0.879 . . . . 0.0 111.093 -178.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -110.88 120.31 5.49 Favored Glycine 0 N--CA 1.444 -0.786 0 N-CA-C 110.253 -1.139 . . . . 0.0 110.253 170.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 25.8 t -107.91 113.51 43.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-O 121.216 0.531 . . . . 0.0 110.346 -174.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.489 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 43.9 mm -103.84 118.12 50.45 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.875 0 CA-C-N 115.467 -0.788 . . . . 0.0 110.249 -178.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.436 ' HG3' ' CE2' ' A' ' 85' ' ' PHE . 86.4 tttt -82.87 130.32 35.12 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.402 0.62 . . . . 0.0 111.164 -178.081 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 31.3 m -126.96 166.92 16.62 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.053 -0.976 . . . . 0.0 109.041 173.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 17.3 m -79.04 -26.02 43.16 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.496 0.665 . . . . 0.0 109.337 177.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 33.6 m -85.47 -5.84 10.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.531 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.25 -157.24 27.12 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.884 -0.675 . . . . 0.0 111.851 -179.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.535 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 83.1 m-85 -124.85 136.55 53.91 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 117.035 0.417 . . . . 0.0 110.333 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.665 HD11 ' HB ' ' A' ' 10' ' ' ILE . 57.1 tp -107.78 135.49 49.1 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.775 0.321 . . . . 0.0 110.382 -178.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.68 ' HB ' HG12 ' A' ' 11' ' ' ILE . 24.9 mm -108.95 127.55 65.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 177.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.838 HG11 ' HB1' ' A' ' 67' ' ' ALA . 11.1 p -112.78 141.01 29.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-O 121.268 0.556 . . . . 0.0 110.542 -176.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.732 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 1.5 tmm_? -142.16 130.92 22.8 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.879 -174.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.676 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.8 mt -87.4 109.68 19.74 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 120.702 0.287 . . . . 0.0 111.31 178.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.477 ' O ' ' HE3' ' A' ' 72' ' ' LYS . 11.9 t70 -79.42 -53.92 6.43 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.662 177.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.535 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 28.7 t0 -156.0 164.52 38.35 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 120.932 -0.307 . . . . 0.0 111.781 -178.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.647 HD13 HG23 ' A' ' 6' ' ' THR . 26.6 mm -134.65 123.84 42.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.125 176.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.683 ' HB2' ' HB2' ' A' ' 98' ' ' HIS . 28.9 pt20 -136.96 134.72 37.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.025 0.441 . . . . 0.0 110.603 178.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.643 ' HA ' ' CB ' ' A' ' 4' ' ' GLN . . . -83.27 62.1 6.49 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.892 0.377 . . . . 0.0 110.637 -179.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.581 ' O ' ' HB3' ' A' ' 102' ' ' HIS . . . 63.76 -84.33 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.817 -177.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 85.4 t60 -87.4 87.24 7.36 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.209 0.528 . . . . 0.0 109.893 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . 0.683 ' HB2' ' HB2' ' A' ' 94' ' ' GLN . 69.1 t60 -98.05 49.9 1.01 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.962 -175.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.405 ' O ' ' HB2' ' A' ' 100' ' ' HIS . 95.7 m-70 53.93 87.73 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.475 -0.784 . . . . 0.0 112.807 173.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.405 ' HB2' ' O ' ' A' ' 99' ' ' HIS . 43.2 m80 75.05 -27.23 0.19 Allowed 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.142 0.577 . . . . 0.0 112.394 174.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -71.44 -29.43 64.86 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 108.78 -0.822 . . . . 0.0 108.78 172.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.581 ' HB3' ' O ' ' A' ' 96' ' ' ALA . 5.9 t60 . . . . . 0 C--O 1.246 0.912 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 176.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.478 0.932 0 CA-C-O 120.809 0.338 . . . . 0.0 110.618 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -72.14 141.95 84.36 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.004 176.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -79.55 140.34 14.94 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.647 2.231 . . . . 0.0 112.891 -174.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.746 HE21 ' HA ' ' A' ' 96' ' ' ALA . 1.5 pt20 -75.59 158.65 32.18 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.132 176.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.491 ' HE ' ' HG2' ' A' ' 56' ' ' GLU . 99.7 mtt180 -121.85 145.73 47.79 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.437 0.637 . . . . 0.0 112.11 -171.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 26.1 m -135.09 141.22 46.01 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.127 -0.942 . . . . 0.0 110.384 -176.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.586 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 57.3 ttt180 -100.4 111.91 24.22 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 109.731 -0.47 . . . . 0.0 109.731 177.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.5 ' HE1' ' HB3' ' A' ' 69' ' ' LEU . 23.1 m-85 -106.67 139.67 40.74 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.154 0.502 . . . . 0.0 111.569 -178.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 50' ' ' GLY . 9.8 m -117.49 132.38 56.56 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 108.571 -0.9 . . . . 0.0 108.571 171.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.69 ' HB ' HD21 ' A' ' 86' ' ' LEU . 2.7 pp -140.69 145.31 25.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 -174.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.637 HG21 ' HA ' ' A' ' 36' ' ' ALA . 7.3 pt -140.46 138.56 36.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 175.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -98.13 118.32 34.48 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.986 0.422 . . . . 0.0 110.163 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.736 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 52.7 p -94.34 149.65 21.03 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.246 174.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.54 ' HB2' ' OE2' ' A' ' 18' ' ' GLU . 25.2 mttp -77.75 -25.47 49.21 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.497 -173.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 p -141.97 168.25 20.2 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 121.084 -0.246 . . . . 0.0 111.357 176.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.432 ' HB2' ' CZ ' ' A' ' 85' ' ' PHE . 23.9 tt0 -64.68 -32.95 74.84 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 179.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -53.71 -41.68 67.25 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 114.456 -1.247 . . . . 0.0 110.632 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.736 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 49.9 mt-10 -69.68 -41.31 75.64 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.384 178.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.545 ' HA ' HD11 ' A' ' 87' ' ' ILE . . . -59.41 -39.1 82.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.405 178.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -55.32 -50.91 68.39 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.812 0.339 . . . . 0.0 110.775 176.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.21 -30.87 70.69 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.08 -177.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.815 HG22 ' HE3' ' A' ' 39' ' ' LYS . 21.9 t -75.51 -52.2 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.899 -0.592 . . . . 0.0 109.806 179.387 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.438 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -66.48 -28.45 68.59 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.051 -176.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.419 ' N ' HD12 ' A' ' 23' ' ' LEU . 17.8 t70 -64.24 -44.2 92.56 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.025 0.441 . . . . 0.0 110.369 175.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.421 ' HG2' HD21 ' A' ' 35' ' ' LEU . 4.2 tp10 -75.53 -45.45 38.01 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.98 -175.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.863 HD13 HD13 ' A' ' 75' ' ' LEU . 3.1 pp -72.55 -14.93 61.75 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.746 0.308 . . . . 0.0 110.984 -179.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.481 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.3 OUTLIER -63.01 -27.69 69.59 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 174.009 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -94.03 -25.62 17.13 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.767 0.794 . . . . 0.0 109.373 173.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.45 45.63 13.75 Favored Glycine 0 N--CA 1.448 -0.514 0 CA-C-N 114.597 -1.183 . . . . 0.0 113.879 168.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.28 -64.26 1.66 Allowed Glycine 0 N--CA 1.445 -0.71 0 C-N-CA 118.706 -1.711 . . . . 0.0 112.593 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.515 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 45.3 t0 -141.1 115.91 9.71 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 117.109 0.454 . . . . 0.0 111.474 171.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.412 ' HA ' HD12 ' A' ' 35' ' ' LEU . 60.8 t80 -77.19 -33.14 56.4 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.817 0.342 . . . . 0.0 110.374 174.466 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -64.3 -30.34 71.39 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.815 -177.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -70.6 -42.21 71.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.425 0.631 . . . . 0.0 109.552 178.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.515 ' HG ' ' O ' ' A' ' 31' ' ' ASP . 13.0 mt -61.28 -45.05 96.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.1 -0.954 . . . . 0.0 109.258 176.089 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.637 ' HA ' HG21 ' A' ' 11' ' ' ILE . . . -56.19 -51.05 69.47 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.31 -1.314 . . . . 0.0 112.244 -176.59 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.669 ' HG2' ' HA ' ' A' ' 47' ' ' ARG . 54.0 mtpt -78.21 -22.65 48.2 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.782 -170.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -80.09 -59.8 2.58 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 114.236 1.198 . . . . 0.0 114.236 -170.15 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.815 ' HE3' HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -103.33 -22.88 13.63 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -171.834 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.417 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 0.7 OUTLIER -75.18 147.67 40.23 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.983 -0.553 . . . . 0.0 112.413 -163.704 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.15 4.12 24.49 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.826 0.822 . . . . 0.0 109.651 174.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.797 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 14.6 t70 -68.92 -15.05 63.39 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.383 -1.281 . . . . 0.0 112.146 179.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.973 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.4 pp -54.81 -14.97 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -153.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.859 ' H ' HD12 ' A' ' 44' ' ' ILE . 4.1 mp -51.62 -40.48 25.87 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 166.641 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 12.7 p -120.04 -6.16 9.99 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.675 177.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.973 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -71.39 -29.88 65.45 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.923 -0.486 . . . . 0.0 111.091 179.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.669 ' HA ' ' HG2' ' A' ' 37' ' ' LYS . 79.7 mtp180 -59.09 -28.58 66.63 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.668 -177.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.407 HD22 ' HB3' ' A' ' 51' ' ' ASP . 2.8 p-10 -90.09 13.24 15.49 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.131 0.491 . . . . 0.0 110.903 176.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.59 21.87 30.43 Favored Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.959 178.392 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.413 ' O ' ' HA ' ' A' ' 9' ' ' SER . . . 72.37 11.34 76.02 Favored Glycine 0 C--N 1.327 0.062 0 C-N-CA 121.033 -0.603 . . . . 0.0 112.185 175.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.407 ' HB3' HD22 ' A' ' 48' ' ' ASN . 4.4 t70 -76.3 115.76 16.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.341 -0.429 . . . . 0.0 110.781 -178.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.528 ' SD ' HG12 ' A' ' 10' ' ' ILE . 88.1 mtp -79.6 -20.94 45.67 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.319 0.58 . . . . 0.0 109.606 177.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 107.83 -162.17 13.3 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.214 -0.903 . . . . 0.0 111.046 -177.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -95.55 119.26 33.74 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.904 0.383 . . . . 0.0 110.811 178.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.482 HD13 ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -108.7 155.85 20.25 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.193 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.491 ' HG2' ' HE ' ' A' ' 5' ' ' ARG . 40.2 mt-10 -93.99 131.07 39.82 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.532 -178.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -61.53 148.94 40.45 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.402 -174.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 63.87 6.77 2.9 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.698 -1.137 . . . . 0.0 111.711 -174.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 5.1 m -112.18 -0.74 15.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 122.24 1.019 . . . . 0.0 108.764 168.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.651 ' O ' ' HE3' ' A' ' 65' ' ' LYS . 24.3 mt -75.2 137.61 72.07 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.524 -175.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.52 ' HG2' HD13 ' A' ' 64' ' ' LEU . 18.8 Cg_endo -61.37 146.12 97.54 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.345 2.03 . . . . 0.0 111.244 174.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.646 ' HA ' ' HD2' ' A' ' 65' ' ' LYS . 7.8 p-10 -56.59 -24.0 44.53 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.251 -172.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -57.64 -49.03 77.8 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.356 0.41 . . . . 0.0 110.802 178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.52 HD13 ' HG2' ' A' ' 61' ' ' PRO . 6.4 mp -83.1 -15.34 51.23 Favored 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 121.083 -0.247 . . . . 0.0 111.317 -178.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.651 ' HE3' ' O ' ' A' ' 60' ' ' ILE . 94.2 mttt -64.08 -34.32 77.76 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.584 0.707 . . . . 0.0 110.089 174.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -71.8 -5.72 36.27 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.819 -1.082 . . . . 0.0 111.527 -178.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.618 ' HB1' HD13 ' A' ' 69' ' ' LEU . . . -70.85 -39.16 73.12 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.088 0.47 . . . . 0.0 111.227 179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 72.13 15.4 76.62 Favored Glycine 0 C--N 1.332 0.345 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.132 -174.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.622 ' C ' HD11 ' A' ' 90' ' ' LEU . 6.7 mp -81.33 78.69 8.09 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.847 0.684 . . . . 0.0 112.847 -174.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.406 ' HA ' ' HD3' ' A' ' 70' ' ' LYS . 70.7 mmtt -102.44 -16.62 16.12 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 175.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -109.08 125.52 52.22 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 122.214 -0.304 . . . . 0.0 111.278 -176.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.799 ' HB2' HD13 ' A' ' 93' ' ' ILE . 87.5 tttt -66.11 133.4 50.65 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.22 0.533 . . . . 0.0 112.139 -169.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 101.58 -3.88 53.73 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.516 -0.766 . . . . 0.0 111.253 -177.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.646 ' HB3' HD12 ' A' ' 90' ' ' LEU . 10.2 tt0 -80.44 114.43 19.34 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-O 121.31 0.576 . . . . 0.0 109.722 175.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.863 HD13 HD13 ' A' ' 26' ' ' LEU . 0.8 OUTLIER -133.64 169.78 16.52 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.911 178.8 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.618 ' HB2' HD11 ' A' ' 26' ' ' LEU . 18.5 t 78.56 46.2 0.05 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 122.007 0.908 . . . . 0.0 110.358 -174.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -96.96 103.74 2.95 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 167.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 17.7 t -103.09 113.13 38.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -174.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 59.9 mt -94.1 109.43 22.03 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.039 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.602 -177.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.428 ' HD2' ' HE2' ' A' ' 85' ' ' PHE . 26.0 tttt -75.28 113.69 12.95 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.391 -174.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.561 ' HB2' ' O ' ' A' ' 84' ' ' GLY . 14.9 m -126.75 137.87 53.3 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 114.403 -1.271 . . . . 0.0 107.936 173.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.8 p -62.47 -26.02 68.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.352 -175.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 19.9 m -79.59 -19.4 12.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.297 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.561 ' O ' ' HB2' ' A' ' 81' ' ' SER . . . 161.08 163.59 14.38 Favored Glycine 0 N--CA 1.444 -0.787 0 N-CA-C 111.006 -0.837 . . . . 0.0 111.006 -175.045 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.432 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 57.8 m-85 -109.6 127.96 54.88 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 120.77 0.319 . . . . 0.0 110.798 -172.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.69 HD21 ' HB ' ' A' ' 10' ' ' ILE . 1.2 tt -111.16 138.49 47.54 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 121.545 0.688 . . . . 0.0 110.666 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.591 ' N ' HD23 ' A' ' 86' ' ' LEU . 6.5 mt -117.46 121.37 67.42 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 CA-C-N 114.557 -1.202 . . . . 0.0 110.588 -175.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.54 HG22 HD22 ' A' ' 69' ' ' LEU . 7.1 p -113.06 141.38 28.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.667 -176.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.724 ' HB2' ' HB3' ' A' ' 75' ' ' LEU . 2.8 ptm180 -138.45 158.31 44.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.449 0.642 . . . . 0.0 110.72 174.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.871 HD22 HD11 ' A' ' 93' ' ' ILE . 12.9 mt -96.57 109.6 22.17 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 114.839 -1.073 . . . . 0.0 111.207 -179.499 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.586 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 21.7 t70 -79.56 -53.91 6.41 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.412 -0.515 . . . . 0.0 111.052 179.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.486 ' C ' HD12 ' A' ' 93' ' ' ILE . 43.2 t0 -155.03 160.57 41.15 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.741 -177.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.871 HD11 HD22 ' A' ' 90' ' ' LEU . 1.7 mp -128.87 136.05 60.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.092 -0.503 . . . . 0.0 109.879 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -127.16 119.8 27.3 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.871 0.367 . . . . 0.0 111.322 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . 63.97 24.19 13.54 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.191 -0.913 . . . . 0.0 112.241 175.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.746 ' HA ' HE21 ' A' ' 4' ' ' GLN . . . -112.21 -75.89 0.6 Allowed 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.933 177.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.484 ' H ' HG21 ' A' ' 93' ' ' ILE . 29.7 t-80 -151.21 116.17 5.25 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 175.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -128.75 -78.03 0.56 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.217 -179.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -146.27 -39.15 0.22 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.917 0.389 . . . . 0.0 110.415 -179.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -72.91 167.17 21.56 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.66 173.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 55.1 t60 -69.38 93.06 0.63 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -171.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 8.8 t-80 . . . . . 0 C--O 1.242 0.665 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 171.03 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 2.5 m . . . . . 0 N--CA 1.477 0.923 0 CA-C-O 121.403 0.62 . . . . 0.0 109.909 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 -172.97 157.6 3.29 Favored Pre-proline 0 N--CA 1.452 -0.368 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.068 -176.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -89.62 109.39 0.43 Allowed 'Trans proline' 0 N--CA 1.446 -1.305 0 C-N-CA 123.017 2.478 . . . . 0.0 111.482 177.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.615 ' HG3' ' HB3' ' A' ' 57' ' ' ASP . 12.7 pt20 -80.74 158.8 25.39 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 109.282 -0.636 . . . . 0.0 109.282 176.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.663 ' HB2' ' HB3' ' A' ' 94' ' ' GLN . 49.6 mtt180 -128.99 151.21 49.93 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.08 0.467 . . . . 0.0 111.51 -171.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 29.9 m -128.62 131.12 48.08 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.717 176.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.539 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 58.8 ttt180 -95.61 111.74 23.61 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.68 -0.408 . . . . 0.0 109.9 -179.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.681 ' HD2' HD21 ' A' ' 55' ' ' LEU . 22.4 m-85 -106.43 146.47 30.47 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.481 0.658 . . . . 0.0 111.131 179.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.471 ' HB2' ' HE ' ' A' ' 89' ' ' ARG . 16.2 m -125.86 132.52 52.17 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 169.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.676 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.9 pp -136.67 149.14 26.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 -175.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.678 HD11 HG11 ' A' ' 22' ' ' VAL . 5.3 pt -140.32 147.59 23.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 177.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -103.99 121.32 42.92 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.386 -176.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.779 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 73.8 p -97.86 153.76 18.1 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.61 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -84.9 -25.57 27.85 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.219 -175.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.0 m -149.9 165.24 33.19 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 176.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.688 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 30.6 tt0 -56.12 -39.34 72.07 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.047 0.451 . . . . 0.0 110.384 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -57.53 -38.6 74.96 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.163 -0.926 . . . . 0.0 110.918 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.976 ' HB3' ' HD2' ' A' ' 39' ' ' LYS . 10.9 mm-40 -64.89 -36.28 83.85 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.82 -176.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.629 ' HA ' HD11 ' A' ' 87' ' ' ILE . . . -70.69 -38.61 73.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.595 178.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.688 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.0 mmtp -58.51 -43.66 89.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.308 179.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.06 -34.27 77.64 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.817 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.678 HG11 HD11 ' A' ' 11' ' ' ILE . 92.1 t -73.52 -49.25 37.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.331 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.669 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.5 pp -65.72 -28.54 69.13 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.215 -176.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.453 ' N ' HD12 ' A' ' 23' ' ' LEU . 19.2 t70 -63.8 -46.47 85.02 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.097 0.475 . . . . 0.0 110.412 178.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -75.07 -38.85 61.18 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.854 -175.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.115 HD11 ' HB3' ' A' ' 76' ' ' SER . 2.7 pp -72.71 -17.09 61.66 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.418 -0.513 . . . . 0.0 111.153 -179.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.509 ' N ' HD12 ' A' ' 26' ' ' LEU . 2.0 m-80 -69.35 -21.16 63.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.121 0.486 . . . . 0.0 110.139 175.111 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -77.63 -26.2 50.36 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 172.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 77.13 31.32 52.96 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-N 114.486 -1.234 . . . . 0.0 112.627 173.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -91.2 -64.11 1.18 Allowed Glycine 0 N--CA 1.443 -0.883 0 C-N-CA 118.758 -1.687 . . . . 0.0 113.301 -177.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.452 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 8.0 t0 -140.1 115.47 9.94 Favored 'General case' 0 C--N 1.322 -0.623 0 O-C-N 122.76 -0.259 . . . . 0.0 111.351 177.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.481 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 93.1 t80 -85.4 -41.31 15.55 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.96 0.41 . . . . 0.0 110.893 172.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.74 -33.81 61.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.259 -178.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.32 -44.52 75.2 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.311 178.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 31' ' ' ASP . 12.4 mt -60.57 -38.36 84.33 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.636 179.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.54 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -59.53 -50.93 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.502 179.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -69.61 -35.33 75.17 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.921 -173.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -78.49 -55.48 5.18 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -175.54 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.976 ' HD2' ' HB3' ' A' ' 18' ' ' GLU . 1.0 OUTLIER -96.73 -24.04 16.14 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.701 0.762 . . . . 0.0 112.869 -166.373 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.629 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 29.0 t -93.44 147.38 23.01 Favored 'General case' 0 C--N 1.291 -1.94 0 O-C-N 121.514 -0.741 . . . . 0.0 112.93 -167.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.53 0.62 41.76 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.11 174.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.663 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 31.4 t70 -59.87 -14.69 16.44 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 114.46 -1.246 . . . . 0.0 112.666 178.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 1.046 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.5 pp -54.73 -14.82 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 -152.326 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.431 ' N ' HD12 ' A' ' 43' ' ' ILE . 44.3 mm -51.82 -33.04 15.19 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.68 0 CA-C-O 121.378 0.608 . . . . 0.0 109.539 165.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.8 m -119.62 -20.39 7.73 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.212 174.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 1.046 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -64.32 -29.98 71.04 Favored 'General case' 0 C--N 1.33 -0.278 0 O-C-N 121.84 -0.537 . . . . 0.0 111.767 -179.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -57.15 -34.28 68.25 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.603 0.239 . . . . 0.0 111.521 -179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -88.71 13.87 11.4 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.233 0.54 . . . . 0.0 110.934 176.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.78 24.66 22.6 Favored Glycine 0 N--CA 1.449 -0.442 0 CA-C-N 115.342 -0.844 . . . . 0.0 113.049 178.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.02 14.2 76.1 Favored Glycine 0 CA--C 1.51 -0.254 0 C-N-CA 121.103 -0.57 . . . . 0.0 112.129 174.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -85.58 115.8 23.49 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.897 0.379 . . . . 0.0 110.311 -176.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.426 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 26.1 ptm -80.64 -19.62 44.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.118 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 115.02 -166.61 12.18 Favored Glycine 0 N--CA 1.439 -1.128 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.737 -178.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.792 ' CZ3' ' HB2' ' A' ' 94' ' ' GLN . 82.4 m95 -98.85 113.37 25.46 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.914 0.387 . . . . 0.0 111.081 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.725 HD13 HG12 ' A' ' 60' ' ' ILE . 2.6 pp -99.64 153.31 19.17 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 115.834 -0.621 . . . . 0.0 109.372 173.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -84.92 132.72 34.34 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -178.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.615 ' HB3' ' HG3' ' A' ' 4' ' ' GLN . 23.8 t70 -67.56 145.39 54.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.292 -175.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 65.4 7.13 4.08 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.903 -173.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 4.8 m -112.72 9.32 19.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 122.032 0.92 . . . . 0.0 108.828 166.095 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.725 HG12 HD13 ' A' ' 55' ' ' LEU . 6.0 mt -81.94 137.79 46.64 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.705 -172.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 60' ' ' ILE . 31.9 Cg_exo -61.27 152.36 72.77 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.742 2.295 . . . . 0.0 111.582 176.356 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.03 -25.26 66.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.718 -0.674 . . . . 0.0 112.77 -168.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.552 ' HA ' ' ND2' ' A' ' 66' ' ' ASN . 41.1 tt0 -70.01 -25.88 63.8 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.377 0.608 . . . . 0.0 110.257 177.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.598 ' HB2' HG22 ' A' ' 60' ' ' ILE . 4.4 mm? -80.93 -22.85 39.33 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.116 176.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -72.97 -44.75 60.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.541 178.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.552 ' ND2' ' HA ' ' A' ' 63' ' ' GLU . 5.0 p30 -74.46 -6.06 46.14 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 120.967 0.413 . . . . 0.0 110.435 -177.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.954 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -62.83 -32.22 73.38 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.402 173.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.22 26.82 54.28 Favored Glycine 0 C--N 1.334 0.455 0 CA-C-N 115.38 -0.827 . . . . 0.0 112.889 175.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.684 HD12 HG22 ' A' ' 88' ' ' VAL . 10.3 mt -102.64 86.88 2.85 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.839 0.352 . . . . 0.0 111.714 -176.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -101.25 -41.9 6.53 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.671 176.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -94.18 127.87 40.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.92 0.391 . . . . 0.0 111.825 -175.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.836 ' HE2' ' HA ' ' A' ' 92' ' ' ASP . 51.0 tttm -66.71 133.77 50.87 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.267 -172.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.04 -8.41 38.79 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.25 -0.74 . . . . 0.0 111.25 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -86.93 128.09 35.06 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-O 121.143 0.497 . . . . 0.0 109.996 178.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.677 HD12 ' HB2' ' A' ' 26' ' ' LEU . 2.2 pt? -144.62 169.9 17.1 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.823 -178.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 1.115 ' HB3' HD11 ' A' ' 26' ' ' LEU . 57.4 p 78.1 45.79 0.06 Allowed 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 125.476 1.51 . . . . 0.0 111.266 -171.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -91.56 103.98 3.11 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 109.914 -1.274 . . . . 0.0 109.914 168.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 16.8 t -97.96 113.6 33.0 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.172 0.51 . . . . 0.0 109.855 -174.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.6 HD11 ' HA ' ' A' ' 67' ' ' ALA . 49.9 mm -103.99 124.07 58.14 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.969 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.439 -177.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -82.56 126.23 32.04 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.132 0.491 . . . . 0.0 110.51 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 32.7 t -129.53 158.84 38.13 Favored 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 175.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.5 p -66.37 -25.84 66.98 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.958 0.409 . . . . 0.0 110.764 178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 34.9 m -83.27 -11.36 11.97 Favored 'Isoleucine or valine' 0 C--O 1.234 0.274 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.423 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.95 -161.39 27.82 Favored Glycine 0 C--O 1.226 -0.366 0 N-CA-C 111.502 -0.639 . . . . 0.0 111.502 -177.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.599 ' HB2' ' OG1' ' A' ' 13' ' ' THR . 95.3 m-85 -111.14 138.68 47.27 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 117.334 0.567 . . . . 0.0 110.842 -178.225 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.676 HD11 ' HB ' ' A' ' 10' ' ' ILE . 36.2 tp -114.53 135.71 53.82 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.939 -0.573 . . . . 0.0 109.944 -177.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.629 HD11 ' HA ' ' A' ' 19' ' ' ALA . 15.7 mt -113.23 121.21 65.0 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.306 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.954 HG11 ' HB1' ' A' ' 67' ' ' ALA . 14.8 p -106.28 140.42 24.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.071 -175.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.481 ' HD3' ' CG ' ' A' ' 32' ' ' PHE . 15.3 ttp85 -132.23 141.79 49.17 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.792 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.665 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.0 mt -94.55 108.83 20.77 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.448 175.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.539 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 22.6 t70 -80.62 -54.98 5.17 Favored 'General case' 0 C--N 1.317 -0.845 0 C-N-CA 120.098 -0.641 . . . . 0.0 111.815 179.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.836 ' HA ' ' HE2' ' A' ' 72' ' ' LYS . 9.1 t70 -156.63 170.13 23.1 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.583 -0.281 . . . . 0.0 111.165 -174.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.43 HG12 ' HB2' ' A' ' 72' ' ' LYS . 45.5 mm -127.59 120.05 53.5 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.792 ' HB2' ' CZ3' ' A' ' 54' ' ' TRP . 6.9 tt0 -102.3 133.93 46.41 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 -169.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.559 ' HA ' ' HD2' ' A' ' 99' ' ' HIS . . . 73.27 -37.38 0.38 Allowed 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 114.1 1.148 . . . . 0.0 114.1 166.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -52.8 102.17 0.05 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 O-C-N 123.595 0.559 . . . . 0.0 112.168 -174.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 70.79 -6.54 1.23 Allowed 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.82 0.7 . . . . 0.0 110.96 178.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -79.55 -29.19 41.29 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.145 -176.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.559 ' HD2' ' HA ' ' A' ' 95' ' ' ALA . 61.3 m-70 -98.6 29.1 3.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.771 176.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 47.3 t60 68.94 3.7 4.13 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.216 0.531 . . . . 0.0 110.848 -178.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -132.13 134.3 45.28 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.328 0.585 . . . . 0.0 111.957 -178.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 . . . . . 0 C--O 1.249 1.038 0 CA-C-N 115.093 -0.958 . . . . 0.0 108.735 173.92 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 9.8 t . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 121.099 0.476 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -116.68 165.03 16.2 Favored Pre-proline 0 C--N 1.325 -0.492 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 175.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -79.5 143.23 16.95 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.139 1.892 . . . . 0.0 112.11 -179.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.511 ' HB2' ' HA ' ' A' ' 95' ' ' ALA . 12.9 pt20 -70.31 158.46 35.88 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 178.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.632 ' HE ' ' HG2' ' A' ' 56' ' ' GLU . 99.1 mtt180 -122.31 135.39 54.72 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.47 0.652 . . . . 0.0 111.741 -173.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.632 HG23 HD13 ' A' ' 93' ' ' ILE . 32.0 m -120.46 137.42 54.35 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.205 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.553 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 62.8 ttt180 -96.25 110.88 23.1 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 177.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.694 ' HD2' HD21 ' A' ' 55' ' ' LEU . 19.2 m-85 -109.27 137.59 46.92 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.144 0.497 . . . . 0.0 111.328 -178.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.701 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 15.3 m -109.8 132.31 54.27 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.464 -0.789 . . . . 0.0 108.913 169.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.739 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.9 pp -142.73 143.82 25.08 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.059 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 -177.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.688 HD11 HG11 ' A' ' 22' ' ' VAL . 12.4 pt -140.18 146.57 24.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.24 175.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -97.41 118.74 34.56 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.102 0.477 . . . . 0.0 110.386 -177.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.518 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 41.3 p -98.06 154.56 17.64 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.516 -179.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.674 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 72.7 mmtt -67.2 -37.63 83.96 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.024 -176.41 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.453 HG22 ' H ' ' A' ' 16' ' ' GLU . 2.7 m -152.37 171.32 18.21 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.182 -0.463 . . . . 0.0 109.835 -176.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.579 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 39.3 tt0 -61.7 -35.26 77.51 Favored 'General case' 0 C--N 1.334 -0.095 0 CA-C-O 121.219 0.533 . . . . 0.0 109.677 179.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -56.32 -43.27 78.82 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.413 175.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.674 ' HG3' ' HB2' ' A' ' 14' ' ' LYS . 6.5 mm-40 -61.52 -41.21 96.98 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.33 177.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.585 ' HB1' HD11 ' A' ' 87' ' ' ILE . . . -60.78 -41.6 95.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.698 178.627 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.579 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.5 mmtp -55.63 -49.07 73.81 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.563 179.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -31.41 72.6 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.016 0.436 . . . . 0.0 111.022 -178.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.688 HG11 HD11 ' A' ' 11' ' ' ILE . 62.8 t -73.78 -51.28 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.172 178.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.602 ' HA ' ' CD2' ' A' ' 26' ' ' LEU . 4.5 pp -65.45 -30.67 71.48 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.595 -174.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.535 ' O ' ' HD3' ' A' ' 28' ' ' LYS . 15.3 t70 -57.18 -53.99 51.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.942 0.401 . . . . 0.0 110.798 -178.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -73.79 -33.69 64.33 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.638 -175.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.748 HD11 ' HB2' ' A' ' 76' ' ' SER . 3.6 pp -73.17 -21.25 60.73 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.345 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 -70.53 -30.2 66.88 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.052 0.453 . . . . 0.0 109.978 172.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.535 ' HD3' ' O ' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -69.43 -31.6 70.03 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 171.656 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.28 33.12 29.57 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.773 -1.103 . . . . 0.0 113.049 171.153 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.56 -64.3 1.21 Allowed Glycine 0 N--CA 1.445 -0.729 0 C-N-CA 118.932 -1.604 . . . . 0.0 112.887 -178.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -140.54 118.66 11.95 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.049 175.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.57 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 32.0 t80 -84.34 -31.21 24.93 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 175.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.456 ' CB ' ' HA2' ' A' ' 49' ' ' GLY . . . -60.68 -34.44 74.35 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.071 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.37 -38.77 88.3 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.319 0.581 . . . . 0.0 110.084 -179.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.701 ' CD1' ' HB3' ' A' ' 26' ' ' LEU . 6.6 mt -66.35 -42.87 87.44 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.988 -1.005 . . . . 0.0 108.94 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.51 ' CB ' HG21 ' A' ' 11' ' ' ILE . . . -64.06 -54.42 34.41 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.596 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.412 ' HA ' HG22 ' A' ' 43' ' ' ILE . 40.0 mtpt -70.16 -32.07 69.85 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.41 -0.814 . . . . 0.0 112.215 -169.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -81.18 -60.01 2.44 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.125 1.158 . . . . 0.0 114.125 -176.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 2.5 ttmm -102.16 -26.03 13.5 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 116.101 1.889 . . . . 0.0 116.101 -167.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.435 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 52.8 p -81.08 162.17 23.85 Favored 'General case' 0 C--N 1.322 -0.605 0 O-C-N 121.536 -0.728 . . . . 0.0 112.833 -170.679 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.7 3.43 29.12 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.194 174.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.521 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 36.1 t70 -71.46 -16.29 62.36 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 114.675 -1.148 . . . . 0.0 111.444 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.96 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.9 pp -56.18 -16.44 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -157.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.733 ' H ' HD12 ' A' ' 44' ' ' ILE . 4.1 mp -57.57 -41.09 78.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-O 121.117 0.484 . . . . 0.0 109.936 170.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.5 m -109.43 -14.35 14.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.294 178.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.96 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -53.04 -28.69 25.75 Favored 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 122.836 0.454 . . . . 0.0 112.142 179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 87.8 mtt180 -53.45 -26.71 21.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.319 178.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.487 ' HB3' ' HB3' ' A' ' 51' ' ' ASP . 85.9 m-20 -79.43 -0.38 32.73 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.86 0.362 . . . . 0.0 110.885 178.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.456 ' HA2' ' CB ' ' A' ' 33' ' ' ALA . . . 90.89 33.25 8.41 Favored Glycine 0 N--CA 1.45 -0.42 0 N-CA-C 111.359 -0.697 . . . . 0.0 111.359 -173.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.535 ' O ' ' HA ' ' A' ' 9' ' ' SER . . . 71.33 11.01 70.95 Favored Glycine 0 C--N 1.334 0.434 0 N-CA-C 111.155 -0.778 . . . . 0.0 111.155 -175.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.487 ' HB3' ' HB3' ' A' ' 48' ' ' ASN . 9.4 t70 -76.74 119.28 20.3 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.124 -0.538 . . . . 0.0 111.924 -172.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 77.9 mmm -77.66 -21.4 52.19 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.495 172.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 102.8 -169.49 19.18 Favored Glycine 0 N--CA 1.437 -1.27 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.011 -176.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.479 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 93.8 m95 -88.13 112.75 23.04 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.181 0.515 . . . . 0.0 110.824 178.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.694 HD21 ' HD2' ' A' ' 8' ' ' TYR . 2.9 pp -105.14 154.7 19.83 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.452 -0.795 . . . . 0.0 109.686 177.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.632 ' HG2' ' HE ' ' A' ' 5' ' ' ARG . 22.8 mt-10 -88.39 127.99 35.51 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -178.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -64.12 151.35 43.44 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 73.02 8.9 5.41 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.02 0.825 . . . . 0.0 111.544 -175.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.2 p -111.49 -0.17 16.3 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 164.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.472 ' CG2' ' HB2' ' A' ' 64' ' ' LEU . 59.5 mt -78.18 129.91 73.91 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 114.268 -1.333 . . . . 0.0 111.6 -171.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 60' ' ' ILE . 20.8 Cg_exo -66.77 156.97 63.48 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 123.138 2.559 . . . . 0.0 111.916 175.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -56.67 -26.86 57.45 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.16 -0.927 . . . . 0.0 112.521 -173.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.465 ' HG3' HG21 ' A' ' 79' ' ' ILE . 0.4 OUTLIER -55.74 -52.37 64.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.876 0.369 . . . . 0.0 110.795 177.323 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.472 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 6.0 mp -83.09 -12.47 57.05 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.942 -178.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -67.33 -49.09 65.51 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.195 -0.669 . . . . 0.0 109.195 172.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -68.05 -13.36 62.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.346 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.846 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -64.67 -27.83 69.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.18 0.514 . . . . 0.0 110.84 177.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 65.38 27.04 72.03 Favored Glycine 0 C--N 1.334 0.462 0 CA-C-N 115.123 -0.944 . . . . 0.0 113.373 174.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.72 HD12 HG22 ' A' ' 88' ' ' VAL . 12.5 mt -97.15 71.22 2.41 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.8 0.333 . . . . 0.0 111.778 -175.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.444 ' HD3' ' HA ' ' A' ' 70' ' ' LYS . 44.2 mmtm -101.97 -25.74 13.66 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.779 0.323 . . . . 0.0 111.663 175.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.3 tp10 -92.96 120.94 33.79 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.844 ' HD2' ' HA ' ' A' ' 92' ' ' ASP . 37.3 ttpt -67.1 144.69 55.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.263 0.554 . . . . 0.0 111.95 -170.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 99.91 -16.3 58.59 Favored Glycine 0 N--CA 1.447 -0.627 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.382 -177.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.435 ' HB3' HD12 ' A' ' 90' ' ' LEU . 9.3 tt0 -81.58 122.89 28.16 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.156 0.503 . . . . 0.0 110.407 -178.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.723 HD13 HD12 ' A' ' 26' ' ' LEU . 0.6 OUTLIER -142.27 169.63 17.23 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.775 -178.493 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.748 ' HB2' HD11 ' A' ' 26' ' ' LEU . 30.8 t 78.49 56.12 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 O-C-N 124.277 0.986 . . . . 0.0 110.775 -176.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -102.83 117.06 5.66 Favored Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 109.919 -1.272 . . . . 0.0 109.919 169.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 14.3 t -99.24 113.45 34.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-O 121.002 0.429 . . . . 0.0 109.957 -174.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.465 HG21 ' HG3' ' A' ' 63' ' ' GLU . 38.9 mm -110.64 120.27 61.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.258 -179.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 81.5 tttt -81.68 132.02 35.28 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.064 0.459 . . . . 0.0 111.059 -179.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.0 m -114.93 167.09 11.09 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.49 -0.777 . . . . 0.0 108.917 172.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 22.5 t -72.46 -26.32 61.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.005 0.431 . . . . 0.0 109.866 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 27.6 m -97.64 -5.54 9.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 115.863 -0.608 . . . . 0.0 112.265 -177.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 162.77 -155.77 27.22 Favored Glycine 0 C--O 1.227 -0.342 0 C-N-CA 120.346 -0.93 . . . . 0.0 112.47 -178.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.492 ' CZ ' ' HB2' ' A' ' 16' ' ' GLU . 82.1 m-85 -127.28 134.73 50.0 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.842 0.353 . . . . 0.0 110.782 -179.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.739 HD11 ' HB ' ' A' ' 10' ' ' ILE . 51.0 tp -110.53 135.47 51.14 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.438 -177.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.685 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 34.7 mm -107.45 126.77 63.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.961 178.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.846 HG11 ' HB1' ' A' ' 67' ' ' ALA . 11.7 p -108.12 140.61 25.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.056 0.455 . . . . 0.0 110.53 -178.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.716 ' HG2' ' HB3' ' A' ' 75' ' ' LEU . 2.5 tmm_? -142.31 133.21 25.74 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.654 -174.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.717 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 12.7 mt -89.09 109.7 20.51 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 111.8 0.296 . . . . 0.0 111.8 176.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.553 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 20.2 t70 -80.44 -54.14 5.96 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 120.112 -0.635 . . . . 0.0 111.358 176.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.844 ' HA ' ' HD2' ' A' ' 72' ' ' LYS . 28.3 t70 -155.35 168.7 26.24 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.545 -179.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.632 HD13 HG23 ' A' ' 6' ' ' THR . 31.4 mm -129.97 131.09 66.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.13 -179.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 15.7 mt-30 -134.63 134.37 41.14 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.729 0.3 . . . . 0.0 110.629 178.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.511 ' HA ' ' HB2' ' A' ' 4' ' ' GLN . . . -90.31 34.41 0.87 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.135 0.493 . . . . 0.0 109.848 172.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 71.32 -61.39 0.49 Allowed 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.78 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . 1.047 ' HA ' ' HA ' ' A' ' 102' ' ' HIS . 38.1 p-80 -148.06 104.63 3.57 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.587 0.708 . . . . 0.0 110.114 175.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . 0.484 ' H ' ' C ' ' A' ' 102' ' ' HIS . 11.7 t-160 -66.78 -53.02 37.36 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.337 -179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -116.42 -74.05 0.62 Allowed 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.399 -0.521 . . . . 0.0 111.154 -177.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 13.3 t-160 -118.01 -72.52 0.68 Allowed 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 121.07 -0.252 . . . . 0.0 110.963 -176.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 72.4 m80 -77.5 -52.24 9.41 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 121.01 0.433 . . . . 0.0 110.12 179.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 1.047 ' HA ' ' HA ' ' A' ' 97' ' ' HIS . 21.9 p-80 . . . . . 0 C--O 1.242 0.677 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 173.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 15.3 t . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.531 ' HB2' ' HB2' ' A' ' 97' ' ' HIS . 26.6 mp0 -114.29 141.79 27.02 Favored Pre-proline 0 C--N 1.326 -0.422 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 178.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.513 ' HD3' ' HA ' ' A' ' 2' ' ' GLN . 1.0 OUTLIER -83.95 142.52 10.02 Favored 'Trans proline' 0 N--CA 1.453 -0.864 0 C-N-CA 123.478 2.786 . . . . 0.0 112.05 -178.885 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.408 ' HA ' ' HB3' ' A' ' 96' ' ' ALA . 12.1 pt20 -70.66 158.95 35.32 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 175.159 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.699 ' HG3' ' HB2' ' A' ' 94' ' ' GLN . 23.9 ptt180 -121.54 139.28 53.71 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 120.162 -0.615 . . . . 0.0 112.0 -176.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.59 HG23 HD13 ' A' ' 93' ' ' ILE . 85.6 m -126.1 141.13 52.07 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.863 -175.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.573 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 56.9 ttt180 -101.42 121.41 41.89 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 110.094 -0.336 . . . . 0.0 110.094 177.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.748 ' HD2' HD21 ' A' ' 55' ' ' LEU . 25.0 m-85 -115.52 130.66 56.95 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.122 0.487 . . . . 0.0 111.886 -178.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.535 ' HB2' ' HE ' ' A' ' 89' ' ' ARG . 16.5 m -112.31 136.31 51.91 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 173.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.664 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.31 146.11 22.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.77 0 N-CA-C 110.262 -0.273 . . . . 0.0 110.262 -175.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.697 HG12 ' HB ' ' A' ' 87' ' ' ILE . 3.0 pt -140.39 143.03 30.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 176.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -99.71 128.33 45.81 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.724 0.297 . . . . 0.0 110.53 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.616 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 11.5 p -103.69 153.82 20.23 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 -178.56 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -76.94 -31.99 57.01 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.976 -177.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.405 HG22 ' N ' ' A' ' 16' ' ' GLU . 7.8 m -151.12 166.26 31.35 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.405 ' N ' HG22 ' A' ' 15' ' ' THR . 25.3 tt0 -56.98 -35.26 68.96 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.269 0.557 . . . . 0.0 110.262 179.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -59.96 -36.96 78.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.454 -0.793 . . . . 0.0 110.842 179.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.81 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 8.3 mm-40 -66.09 -35.76 81.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.003 178.744 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -67.88 -47.33 69.15 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.5 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.473 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 1.6 mptm? -55.93 -44.16 78.08 Favored 'General case' 0 C--N 1.334 -0.089 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.947 177.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.28 -33.11 74.62 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.208 0.528 . . . . 0.0 110.818 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.839 HG22 ' HB3' ' A' ' 35' ' ' LEU . 0.8 OUTLIER -76.11 -39.72 36.34 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.779 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.221 -178.416 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.754 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -72.5 -27.3 62.18 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.216 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.406 ' N ' HD12 ' A' ' 23' ' ' LEU . 31.0 t70 -59.22 -41.25 88.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.684 177.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -75.29 -47.87 25.87 Favored 'General case' 0 C--O 1.226 -0.157 0 CA-C-O 120.867 0.365 . . . . 0.0 110.139 -179.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.754 ' HG ' ' HA ' ' A' ' 23' ' ' LEU . 3.9 pp -67.94 -14.57 63.07 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.694 -0.403 . . . . 0.0 111.165 -178.006 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -71.01 -24.74 62.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.16 172.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -86.27 -32.75 20.94 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 168.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 78.84 36.64 28.17 Favored Glycine 0 N--CA 1.44 -1.047 0 CA-C-N 114.141 -1.39 . . . . 0.0 112.235 176.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -81.3 -62.31 1.99 Allowed Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 119.106 -1.521 . . . . 0.0 112.191 -176.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.412 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 25.8 t0 -139.32 114.41 9.55 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 121.026 -0.27 . . . . 0.0 110.531 176.188 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.532 ' CD2' ' HG3' ' A' ' 89' ' ' ARG . 46.1 t80 -85.57 -37.34 19.69 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.081 0.467 . . . . 0.0 110.27 174.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -58.38 -33.07 69.21 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.863 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.65 -41.83 83.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.385 177.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.839 ' HB3' HG22 ' A' ' 22' ' ' VAL . 7.1 mt -60.14 -44.26 95.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.384 178.509 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.5 ' O ' ' HB2' ' A' ' 40' ' ' SER . . . -61.07 -48.0 83.76 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 114.651 -1.159 . . . . 0.0 111.809 -179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.7 mtpp -73.54 -42.53 61.6 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.356 -170.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -79.5 -57.9 3.46 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -169.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.81 ' HD3' ' HB3' ' A' ' 18' ' ' GLU . 0.7 OUTLIER -101.38 -25.28 14.0 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.747 0.784 . . . . 0.0 112.662 -168.279 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.5 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 9.8 m -75.86 146.77 39.58 Favored 'General case' 0 C--N 1.307 -1.24 0 CA-C-N 114.996 -1.002 . . . . 0.0 112.469 -172.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -80.01 2.56 23.25 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 122.033 0.92 . . . . 0.0 109.745 174.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.591 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 37.3 t70 -60.2 -16.29 31.92 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.08 -1.418 . . . . 0.0 112.382 176.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.969 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.8 pp -56.17 -16.12 2.86 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 N-CA-C 114.78 1.4 . . . . 0.0 114.78 -156.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.647 ' H ' HD12 ' A' ' 44' ' ' ILE . 3.6 mp -53.39 -42.03 46.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 121.164 0.507 . . . . 0.0 109.963 169.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.2 m -110.15 -16.67 13.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.035 178.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.969 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -51.47 -28.21 12.61 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -176.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -53.59 -26.61 22.44 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 111.9 0.333 . . . . 0.0 111.9 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 35.5 p30 -89.82 10.67 22.72 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.973 0.416 . . . . 0.0 110.974 178.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.56 24.04 27.03 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.815 -177.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 66.98 40.48 93.4 Favored Glycine 0 CA--C 1.507 -0.409 0 C-N-CA 121.198 -0.525 . . . . 0.0 112.329 177.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.521 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 23.5 t70 -119.12 133.59 55.7 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 121.314 0.578 . . . . 0.0 111.353 -173.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.8 mmt -82.26 -19.88 38.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.081 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.69 -162.42 15.63 Favored Glycine 0 N--CA 1.44 -1.055 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.011 177.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.544 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 91.1 m95 -95.1 111.72 23.51 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 121.414 0.626 . . . . 0.0 110.906 -179.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.894 HD13 HG12 ' A' ' 60' ' ' ILE . 2.0 pp -108.71 156.92 19.04 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.483 177.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.478 ' HB2' ' OG1' ' A' ' 59' ' ' THR . 17.6 mp0 -81.76 144.89 30.77 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -64.92 136.5 56.9 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 177.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.04 8.06 6.5 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 124.298 0.999 . . . . 0.0 112.731 -178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.478 ' OG1' ' HB2' ' A' ' 56' ' ' GLU . 62.2 p -111.39 6.07 20.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 122.093 0.949 . . . . 0.0 108.676 166.863 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.894 HG12 HD13 ' A' ' 55' ' ' LEU . 13.5 mt -69.47 141.02 90.32 Favored Pre-proline 0 C--N 1.323 -0.569 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.381 -175.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.04 142.45 97.34 Favored 'Trans proline' 0 C--O 1.237 0.432 0 C-N-CA 122.232 1.954 . . . . 0.0 110.898 172.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.455 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 1.7 m-20 -55.04 -29.9 58.42 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 115.334 -0.848 . . . . 0.0 112.857 -169.762 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.537 ' HA ' ' ND2' ' A' ' 66' ' ' ASN . 35.0 tt0 -65.56 -36.41 83.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 120.863 0.363 . . . . 0.0 111.106 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.407 ' HB2' HG22 ' A' ' 60' ' ' ILE . 5.2 mp -83.66 -25.84 30.37 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.499 -0.48 . . . . 0.0 111.047 178.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.459 ' CG ' ' HB ' ' A' ' 60' ' ' ILE . 52.2 mtmt -73.86 -27.38 61.05 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 177.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . 0.537 ' ND2' ' HA ' ' A' ' 63' ' ' GLU . 3.2 p30 -84.5 -5.78 59.32 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-O 121.064 0.459 . . . . 0.0 110.054 176.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.987 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -68.21 -28.45 67.26 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.697 -178.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 86.39 23.05 45.26 Favored Glycine 0 C--N 1.331 0.259 0 C-N-CA 120.979 -0.629 . . . . 0.0 113.315 176.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.634 ' HB3' ' CD1' ' A' ' 90' ' ' LEU . 11.1 mt -101.98 109.57 21.33 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 179.021 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.484 ' HA ' ' HD2' ' A' ' 70' ' ' LYS . 15.2 tptp -102.66 -60.1 1.6 Allowed 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 119.671 -0.812 . . . . 0.0 111.996 171.548 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.665 ' O ' HD13 ' A' ' 90' ' ' LEU . 25.5 mt-10 -107.81 152.03 24.94 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.268 0.556 . . . . 0.0 112.374 -169.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.719 ' HB2' HG12 ' A' ' 93' ' ' ILE . 35.6 tttp -66.4 138.31 57.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.125 -0.943 . . . . 0.0 112.207 -167.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.94 -9.62 37.1 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 120.875 -0.678 . . . . 0.0 111.804 177.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.429 ' HB3' HD12 ' A' ' 90' ' ' LEU . 9.8 tt0 -91.25 114.89 27.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.029 0.442 . . . . 0.0 109.936 175.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.597 HD12 ' HB2' ' A' ' 26' ' ' LEU . 2.4 pt? -143.12 170.08 16.38 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.015 -0.539 . . . . 0.0 109.963 -177.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.687 ' HB2' HD11 ' A' ' 26' ' ' LEU . 23.7 t 78.15 45.71 0.06 Allowed 'General case' 0 N--CA 1.466 0.358 0 O-C-N 124.164 0.915 . . . . 0.0 110.159 -172.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -92.89 104.42 3.18 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 171.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 25.4 t -90.51 113.04 25.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -176.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.731 HD11 ' HA ' ' A' ' 67' ' ' ALA . 41.1 mm -103.21 114.2 42.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.81 -176.095 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.564 ' HG2' ' HE1' ' A' ' 85' ' ' PHE . 4.5 tmtm? -72.02 113.43 9.04 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.108 -179.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 35.5 t -119.05 161.45 20.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.446 -176.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.6 m -65.94 -26.39 67.57 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.827 177.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 35.6 m -92.79 -5.77 10.68 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.746 -178.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 143.66 -129.65 3.77 Favored Glycine 0 CA--C 1.508 -0.378 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 -176.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.564 ' HE1' ' HG2' ' A' ' 80' ' ' LYS . 97.0 m-85 -134.05 135.26 43.21 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.058 0.456 . . . . 0.0 110.613 177.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.664 HD11 ' HB ' ' A' ' 10' ' ' ILE . 50.5 tp -106.15 135.33 47.81 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.351 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.697 ' HB ' HG12 ' A' ' 11' ' ' ILE . 27.5 mm -105.7 118.6 53.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 N-CA-C 109.813 -0.439 . . . . 0.0 109.813 178.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.987 HG11 ' HB1' ' A' ' 67' ' ' ALA . 10.7 p -103.82 136.92 34.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-O 121.319 0.581 . . . . 0.0 109.902 -178.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.535 ' HE ' ' HB2' ' A' ' 9' ' ' SER . 2.4 tmm_? -137.74 119.13 14.73 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.286 -173.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.665 HD13 ' O ' ' A' ' 71' ' ' GLU . 8.4 mt -77.6 109.0 11.19 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.398 176.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.573 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 32.2 t70 -79.59 -54.18 6.13 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 119.824 -0.751 . . . . 0.0 111.533 179.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.544 ' HB3' ' CH2' ' A' ' 54' ' ' TRP . 5.0 t70 -155.5 170.11 22.71 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.954 -0.298 . . . . 0.0 111.164 -177.47 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.719 HG12 ' HB2' ' A' ' 72' ' ' LYS . 32.7 mm -135.44 128.74 48.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.384 -178.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.699 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . 47.5 mt-30 -119.31 118.67 31.86 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 172.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.52 75.97 10.1 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.44 0.638 . . . . 0.0 109.86 176.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.408 ' HB3' ' HA ' ' A' ' 4' ' ' GLN . . . -59.52 136.64 58.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.219 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.592 ' H ' ' HB3' ' A' ' 102' ' ' HIS . 85.3 t60 75.35 115.4 0.06 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 114.891 -1.05 . . . . 0.0 111.282 179.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 4.4 m170 -145.73 -44.81 0.21 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 114.973 -1.012 . . . . 0.0 110.582 179.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -176.29 -72.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.364 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 11.5 t-80 -112.89 -20.67 11.5 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.679 -178.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 14.6 m-70 -66.06 -39.51 90.14 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.311 0.577 . . . . 0.0 109.687 174.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.592 ' HB3' ' H ' ' A' ' 97' ' ' HIS . 3.5 t-160 . . . . . 0 C--O 1.246 0.897 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 178.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 28.0 m . . . . . 0 N--CA 1.476 0.837 0 CA-C-O 120.807 0.337 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.733 HE21 ' HD2' ' A' ' 3' ' ' PRO . 0.5 OUTLIER -90.3 135.06 30.14 Favored Pre-proline 0 C--N 1.324 -0.501 0 CA-C-O 121.722 0.772 . . . . 0.0 111.713 -177.379 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.733 ' HD2' HE21 ' A' ' 2' ' ' GLN . 94.4 Cg_endo -78.78 151.41 24.72 Favored 'Trans proline' 0 C--N 1.33 -0.425 0 C-N-CA 124.211 3.274 . . . . 0.0 111.723 176.403 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -69.41 157.16 37.61 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.535 ' HG2' ' HA ' ' A' ' 56' ' ' GLU . 99.9 mtt180 -130.17 151.11 51.05 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 120.998 0.428 . . . . 0.0 110.448 -176.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.829 HG23 HG13 ' A' ' 93' ' ' ILE . 30.7 m -136.82 137.17 39.48 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.504 -178.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.563 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 62.9 ttt180 -96.95 111.83 23.86 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.345 -0.389 . . . . 0.0 109.953 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 -109.79 138.32 46.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.103 0.477 . . . . 0.0 111.308 -179.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.532 ' HB2' ' CG ' ' A' ' 89' ' ' ARG . 6.5 m -112.31 132.71 54.82 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 172.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.577 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.7 pp -137.77 144.29 31.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 110.541 -0.17 . . . . 0.0 110.541 -176.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.675 HD11 HG11 ' A' ' 22' ' ' VAL . 6.1 pt -140.43 146.95 23.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 174.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -97.66 126.57 43.05 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.898 0.38 . . . . 0.0 110.828 -178.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.717 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 12.9 p -103.03 140.37 37.37 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.475 177.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -64.65 -32.2 73.76 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.783 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.419 HG22 ' H ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -150.9 171.71 16.82 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.54 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.665 ' HG2' ' HE3' ' A' ' 20' ' ' LYS . 33.8 tt0 -62.2 -36.25 81.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.246 0.546 . . . . 0.0 109.633 -179.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -53.89 -40.31 66.49 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.667 177.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.717 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 8.6 mm-40 -69.14 -41.2 77.62 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.776 -179.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.556 ' HA ' HG21 ' A' ' 13' ' ' THR . . . -59.18 -44.85 92.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.327 177.406 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.665 ' HE3' ' HG2' ' A' ' 16' ' ' GLU . 33.3 mmtp -55.89 -48.0 76.39 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.291 176.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.06 -33.07 73.72 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.108 0.48 . . . . 0.0 110.972 -179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.675 HG11 HD11 ' A' ' 11' ' ' ILE . 79.4 t -73.73 -50.37 29.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.25 178.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.8 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.6 pp -68.17 -30.53 69.66 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.138 -176.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.477 ' O ' ' HB2' ' A' ' 27' ' ' ASN . 12.8 t70 -64.3 -41.23 96.97 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.1 0.476 . . . . 0.0 110.235 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -76.07 -39.07 56.23 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.186 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.813 HD13 ' HB3' ' A' ' 75' ' ' LEU . 4.1 pp -71.87 -13.87 61.79 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 120.482 -0.487 . . . . 0.0 110.159 177.45 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 24' ' ' ASP . 0.5 OUTLIER -62.91 -33.14 74.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.987 172.675 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -71.92 -29.75 64.63 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 121.605 0.717 . . . . 0.0 109.371 172.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.75 29.7 46.72 Favored Glycine 0 N--CA 1.445 -0.709 0 CA-C-N 115.03 -0.987 . . . . 0.0 112.334 178.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -89.84 -63.2 1.28 Allowed Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 119.377 -1.392 . . . . 0.0 113.326 -175.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.408 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 9.4 t0 -139.28 115.72 10.55 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 117.241 0.521 . . . . 0.0 111.86 178.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.456 ' HA ' HD12 ' A' ' 35' ' ' LEU . 73.3 t80 -84.89 -41.07 16.32 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.791 0.329 . . . . 0.0 110.816 172.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -56.43 -33.47 65.88 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.111 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.79 -44.52 85.51 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.091 178.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.456 HD12 ' HA ' ' A' ' 32' ' ' PHE . 12.9 mt -62.54 -37.26 85.42 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.395 179.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.549 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -62.52 -48.28 80.23 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.433 -1.258 . . . . 0.0 111.351 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.691 ' HA ' HG22 ' A' ' 43' ' ' ILE . 54.8 mtpt -79.1 -33.86 44.05 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.124 -173.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -79.81 -55.68 4.81 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -177.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.842 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -97.85 -24.54 15.38 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.664 0.745 . . . . 0.0 112.919 -168.303 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.549 ' HB3' ' O ' ' A' ' 36' ' ' ALA . 43.2 t -89.6 152.29 21.47 Favored 'General case' 0 C--N 1.291 -1.953 0 O-C-N 121.133 -0.979 . . . . 0.0 113.008 -167.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.38 0.93 39.65 Favored 'General case' 0 C--N 1.334 -0.069 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.102 172.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.518 ' HB3' ' HB2' ' A' ' 46' ' ' ALA . 20.2 t70 -65.07 -15.99 62.97 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.501 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 1.06 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.6 pp -55.39 -16.35 2.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -157.634 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.472 ' N ' HD12 ' A' ' 43' ' ' ILE . 77.7 mt -51.76 -43.11 33.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.258 0.551 . . . . 0.0 109.603 167.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 23.9 m -109.41 -25.56 10.46 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.139 176.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 1.06 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -50.96 -29.0 11.05 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -174.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 75.3 mtp180 -53.74 -24.5 15.12 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 177.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -89.4 10.65 21.76 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.033 0.445 . . . . 0.0 110.898 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.22 22.83 31.15 Favored Glycine 0 N--CA 1.449 -0.449 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.359 -178.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.405 ' O ' ' HA ' ' A' ' 9' ' ' SER . . . 62.21 29.19 72.26 Favored Glycine 0 C--N 1.331 0.284 0 N-CA-C 111.679 -0.568 . . . . 0.0 111.679 -178.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -90.56 113.58 25.62 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.289 0.566 . . . . 0.0 111.226 -172.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 96.7 mmm -75.51 -19.22 59.51 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.111 177.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 100.15 -149.11 18.64 Favored Glycine 0 N--CA 1.437 -1.253 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.641 178.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.646 ' CZ3' ' HG2' ' A' ' 94' ' ' GLN . 86.7 m95 -109.3 111.82 23.61 Favored 'General case' 0 C--N 1.315 -0.92 0 CA-C-O 121.23 0.538 . . . . 0.0 111.212 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.498 ' O ' HD12 ' A' ' 55' ' ' LEU . 1.4 pp -99.0 153.12 19.1 Favored 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.679 174.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.535 ' HA ' ' HG2' ' A' ' 5' ' ' ARG . 21.7 mt-10 -90.51 140.28 29.88 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -67.39 149.56 50.12 Favored 'General case' 0 C--N 1.314 -0.97 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.121 -178.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.32 7.42 6.21 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.065 -175.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 18.8 p -112.18 3.91 17.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.717 0.77 . . . . 0.0 109.116 167.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.511 ' HB ' ' HD3' ' A' ' 65' ' ' LYS . 22.2 mt -87.13 136.17 34.12 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.049 -169.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -61.53 139.47 81.9 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.265 1.977 . . . . 0.0 110.718 171.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -58.61 -23.86 59.72 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.701 -0.681 . . . . 0.0 112.136 -172.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -54.01 -47.58 71.34 Favored 'General case' 0 C--N 1.329 -0.318 0 O-C-N 123.161 0.288 . . . . 0.0 110.892 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.6 mp -83.33 -23.15 32.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.636 0.255 . . . . 0.0 111.381 -178.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.511 ' HD3' ' HB ' ' A' ' 60' ' ' ILE . 32.1 mmmt -69.83 -37.53 76.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.009 0.433 . . . . 0.0 110.22 176.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 37.2 m-80 -80.19 -5.27 55.81 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.219 179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.77 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -57.69 -25.13 59.86 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-O 120.856 0.36 . . . . 0.0 111.918 -179.493 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 80.86 19.9 66.72 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.313 177.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.674 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 15.3 mt -95.43 94.12 7.62 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.186 0.517 . . . . 0.0 111.678 -175.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -101.22 -47.84 4.59 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.936 176.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.46 ' O ' HD13 ' A' ' 90' ' ' LEU . 35.6 mm-40 -84.74 129.75 34.78 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.078 -171.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 92' ' ' ASP . 63.3 tttm -66.31 117.66 8.88 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.103 0.478 . . . . 0.0 111.073 -174.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 102.67 -1.16 48.99 Favored Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.653 -177.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.419 ' HB3' HD12 ' A' ' 90' ' ' LEU . 8.5 tt0 -68.54 126.63 30.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.813 ' HB3' HD13 ' A' ' 26' ' ' LEU . 62.8 mt -116.54 166.08 12.5 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.819 -174.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.509 ' HB2' HD11 ' A' ' 26' ' ' LEU . 12.5 t 76.33 57.82 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.877 0.846 . . . . 0.0 111.106 168.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.443 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -102.4 103.84 2.51 Favored Glycine 0 N--CA 1.439 -1.14 0 N-CA-C 110.146 -1.182 . . . . 0.0 110.146 169.433 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 26.3 t -98.97 113.06 32.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-O 121.152 0.501 . . . . 0.0 109.77 -175.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.443 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 79.2 mt -102.29 116.97 46.93 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.86 -178.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -86.76 127.11 34.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.357 0.599 . . . . 0.0 111.471 -177.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 70.5 m -128.91 155.2 45.66 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.014 174.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.4 m -59.84 -27.15 66.39 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.949 0.404 . . . . 0.0 111.424 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 10.0 p -87.23 -17.82 8.63 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.477 -177.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 158.86 -171.19 35.45 Favored Glycine 0 N--CA 1.449 -0.5 0 C-N-CA 120.801 -0.714 . . . . 0.0 111.964 -177.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -112.06 140.67 46.55 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 120.754 0.311 . . . . 0.0 110.904 -176.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.472 HD11 ' HB ' ' A' ' 10' ' ' ILE . 34.1 tp -113.24 135.76 53.48 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.412 -179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.614 ' HB ' HG12 ' A' ' 11' ' ' ILE . 24.2 mm -104.7 130.69 55.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 109.611 -0.515 . . . . 0.0 109.611 177.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.77 HG11 ' HB1' ' A' ' 67' ' ' ALA . 13.6 p -125.18 140.76 47.25 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 -177.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.692 ' NH2' ' HA ' ' A' ' 91' ' ' ASP . 0.2 OUTLIER -142.14 158.7 43.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.327 0.584 . . . . 0.0 110.862 177.023 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.959 HD22 HD11 ' A' ' 93' ' ' ILE . 10.8 mt -99.95 108.86 21.18 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.479 -177.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.692 ' HA ' ' NH2' ' A' ' 89' ' ' ARG . 19.0 t70 -81.07 -54.08 5.85 Favored 'General case' 0 C--N 1.315 -0.892 0 C-N-CA 120.322 -0.551 . . . . 0.0 111.826 177.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.622 ' HA ' ' HE2' ' A' ' 72' ' ' LYS . 9.1 t70 -155.98 152.99 28.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.458 -177.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.959 HD11 HD22 ' A' ' 90' ' ' LEU . 4.7 mp -133.1 128.32 55.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.646 ' HG2' ' CZ3' ' A' ' 54' ' ' TRP . 25.4 pt20 -132.21 129.28 39.49 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.264 0.555 . . . . 0.0 110.993 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -85.02 45.42 1.17 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.583 177.147 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.428 ' HB1' ' HG2' ' A' ' 2' ' ' GLN . . . 63.23 -162.27 0.28 Allowed 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 115.212 -0.903 . . . . 0.0 111.601 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 15.3 m-70 -94.31 -99.71 0.15 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 -179.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 41.5 t60 62.35 -72.7 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 123.715 0.806 . . . . 0.0 111.647 179.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.432 ' H ' ' H ' ' A' ' 100' ' ' HIS . 38.0 t60 -153.96 -14.53 0.14 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.011 0.434 . . . . 0.0 109.886 178.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 0.432 ' H ' ' H ' ' A' ' 99' ' ' HIS . 63.1 m80 -77.72 149.35 34.58 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.995 -177.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 17.5 m-70 -75.82 97.07 3.81 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.194 0.521 . . . . 0.0 110.4 179.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 51.2 p-80 . . . . . 0 C--O 1.248 0.987 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.067 178.406 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 31.5 m . . . . . 0 N--CA 1.476 0.852 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.456 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 76.4 mt-30 -71.58 124.83 91.54 Favored Pre-proline 0 CA--C 1.515 -0.37 0 CA-C-O 121.128 0.49 . . . . 0.0 111.331 -178.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 2' ' ' GLN . 93.9 Cg_endo -92.3 150.08 3.04 Favored 'Trans proline' 0 N--CA 1.446 -1.291 0 C-N-CA 123.791 2.994 . . . . 0.0 110.509 175.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.637 ' HB2' ' HB2' ' A' ' 96' ' ' ALA . 10.1 pt20 -71.12 148.89 46.98 Favored 'General case' 0 N--CA 1.443 -0.778 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.602 ' HG3' ' HB2' ' A' ' 94' ' ' GLN . 25.0 ptt180 -122.35 129.8 52.48 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.355 0.598 . . . . 0.0 109.9 176.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.557 HG23 HG23 ' A' ' 93' ' ' ILE . 20.6 m -120.27 141.39 50.03 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.056 -0.975 . . . . 0.0 109.987 -174.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.634 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 66.0 ttt180 -95.02 111.0 22.85 Favored 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 120.071 -0.652 . . . . 0.0 109.249 177.034 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.408 ' HE2' HD13 ' A' ' 60' ' ' ILE . 15.2 m-85 -106.91 135.08 49.07 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.381 0.61 . . . . 0.0 111.239 -178.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.579 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 20.4 m -112.36 134.82 53.69 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.272 -0.876 . . . . 0.0 108.846 169.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.643 ' HA ' ' O ' ' A' ' 87' ' ' ILE . 2.8 pp -139.59 143.06 31.46 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.907 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -177.125 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.732 ' HA ' ' HB2' ' A' ' 42' ' ' ASP . 1.1 pt -138.04 141.76 37.53 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 -96.8 117.35 30.89 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -179.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.646 HG22 ' HE3' ' A' ' 39' ' ' LYS . 2.5 p -94.36 147.88 22.78 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-O 121.384 0.612 . . . . 0.0 110.916 -175.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.624 ' HB2' ' HG3' ' A' ' 18' ' ' GLU . 10.8 mmmm -64.77 -33.85 76.96 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 114.762 -1.108 . . . . 0.0 111.649 -171.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.491 HG22 ' H ' ' A' ' 16' ' ' GLU . 10.4 m -157.36 171.16 20.89 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.491 ' H ' HG22 ' A' ' 15' ' ' THR . 29.5 tt0 -57.63 -35.4 70.44 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.248 0.547 . . . . 0.0 110.323 -179.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -54.0 -43.11 69.75 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.497 176.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.624 ' HG3' ' HB2' ' A' ' 14' ' ' LYS . 8.1 mm-40 -64.32 -42.4 96.34 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.39 179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.506 ' CB ' HD11 ' A' ' 87' ' ' ILE . . . -62.07 -46.39 89.35 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.975 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.641 ' HD3' HD21 ' A' ' 23' ' ' LEU . 30.0 mmtp -60.43 -39.67 88.29 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.971 178.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.19 -31.57 72.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.008 0.432 . . . . 0.0 110.871 177.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.615 HG23 ' O ' ' A' ' 18' ' ' GLU . 81.4 t -72.92 -50.58 31.69 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.865 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.641 HD21 ' HD3' ' A' ' 20' ' ' LYS . 4.2 pp -65.72 -27.64 68.47 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.336 -176.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.417 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.7 t70 -64.1 -53.52 48.42 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.003 0.43 . . . . 0.0 110.302 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.467 ' HG2' HD21 ' A' ' 35' ' ' LEU . 1.5 tp10 -66.37 -41.4 89.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.976 -175.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.92 HD11 ' HB2' ' A' ' 76' ' ' SER . 3.8 pp -73.08 -16.67 61.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.012 -179.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.434 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -71.38 -30.68 66.41 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 175.129 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.7 mptt -76.02 -32.6 59.46 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 169.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 80.62 36.37 23.14 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 114.518 -1.219 . . . . 0.0 113.749 168.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -85.38 -63.73 1.55 Allowed Glycine 0 N--CA 1.444 -0.812 0 C-N-CA 118.871 -1.633 . . . . 0.0 112.404 -178.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -139.95 121.23 14.92 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 116.824 0.312 . . . . 0.0 110.93 173.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 80.8 t80 -84.51 -32.06 24.13 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.095 0.474 . . . . 0.0 110.3 174.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -57.65 -35.98 71.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.087 -179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -68.32 -36.22 78.98 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.353 0.597 . . . . 0.0 110.289 -178.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.467 HD21 ' HG2' ' A' ' 25' ' ' GLU . 6.6 mt -69.56 -32.92 71.99 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.242 -178.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.545 ' HB2' HG21 ' A' ' 11' ' ' ILE . . . -71.23 -46.2 61.6 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.545 -1.207 . . . . 0.0 111.562 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 37.7 mtpt -77.76 -28.75 50.68 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -168.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -79.34 -61.8 1.89 Allowed 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -169.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.646 ' HE3' HG22 ' A' ' 13' ' ' THR . 0.0 OUTLIER -104.16 -21.99 13.47 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 -179.903 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.524 ' HB2' ' O ' ' A' ' 36' ' ' ALA . 10.4 m -75.21 143.73 43.0 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.205 0.526 . . . . 0.0 111.53 -168.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -76.84 5.84 7.13 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.778 -177.897 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.732 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 18.9 t70 -64.03 -16.26 61.27 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.243 -1.344 . . . . 0.0 111.767 176.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.963 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.6 pp -55.83 -15.51 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 -159.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.43 ' N ' HD12 ' A' ' 43' ' ' ILE . 66.5 mt -58.11 -44.14 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 CA-C-O 121.096 0.474 . . . . 0.0 109.849 167.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -109.65 -13.84 14.45 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.931 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.963 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -53.3 -29.07 31.46 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 122.765 0.426 . . . . 0.0 111.777 178.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -55.08 -19.4 7.23 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.513 177.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 41.9 m-20 -89.96 0.22 57.21 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.84 0.352 . . . . 0.0 110.614 177.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.47 29.31 14.37 Favored Glycine 0 N--CA 1.447 -0.572 0 N-CA-C 111.131 -0.787 . . . . 0.0 111.131 -173.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.545 ' HA2' ' OD2' ' A' ' 42' ' ' ASP . . . 80.36 -2.64 76.38 Favored Glycine 0 N--CA 1.453 -0.222 0 N-CA-C 111.457 -0.657 . . . . 0.0 111.457 -175.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -73.86 122.23 22.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.101 0.477 . . . . 0.0 111.846 -175.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.487 ' SD ' HG12 ' A' ' 10' ' ' ILE . 87.6 mtp -78.1 -34.46 50.13 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.149 172.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 120.15 -172.14 14.8 Favored Glycine 0 N--CA 1.438 -1.19 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.186 -174.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.531 ' CH2' ' HB3' ' A' ' 92' ' ' ASP . 94.6 m95 -89.68 120.71 31.19 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-O 120.824 0.345 . . . . 0.0 111.078 178.525 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.521 HD23 ' O ' ' A' ' 55' ' ' LEU . 0.6 OUTLIER -115.7 155.37 27.85 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 174.644 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -88.5 139.57 30.34 Favored 'General case' 0 C--N 1.313 -1.02 0 CA-C-O 120.967 0.413 . . . . 0.0 109.924 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.414 ' O ' ' HB3' ' A' ' 58' ' ' ALA . 27.9 t0 -56.96 151.32 15.02 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.337 173.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.414 ' HB3' ' O ' ' A' ' 57' ' ' ASP . . . 72.5 7.11 5.58 Favored 'General case' 0 C--N 1.323 -0.562 0 O-C-N 124.319 1.012 . . . . 0.0 110.943 -172.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 27.2 m -111.53 -0.25 16.23 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 162.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.708 ' HB ' ' HE2' ' A' ' 65' ' ' LYS . 56.6 mt -88.39 115.59 63.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.62 -176.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.26 157.66 58.87 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.166 2.577 . . . . 0.0 111.65 178.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.624 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . 4.7 m-20 -56.79 -20.96 25.23 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.915 -178.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -57.47 -52.64 64.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.478 175.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.447 ' O ' ' HB3' ' A' ' 67' ' ' ALA . 6.3 mp -82.93 -14.23 54.54 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 120.929 0.395 . . . . 0.0 110.708 -179.821 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.708 ' HE2' ' HB ' ' A' ' 60' ' ' ILE . 72.2 mmtt -73.3 -34.4 65.71 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 172.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 66.0 m-20 -75.15 -5.8 46.24 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.736 174.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.956 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -74.43 -32.25 62.57 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.202 175.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 73.8 21.55 79.17 Favored Glycine 0 C--N 1.336 0.529 0 CA-C-N 115.393 -0.821 . . . . 0.0 113.016 176.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.686 HD13 ' HG ' ' A' ' 90' ' ' LEU . 12.4 mt -86.41 94.64 9.44 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.071 0.463 . . . . 0.0 111.396 -177.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 22.0 tptm -100.29 -54.73 2.79 Favored 'General case' 0 N--CA 1.447 -0.608 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.308 -179.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.531 ' O ' HD13 ' A' ' 90' ' ' LEU . 36.8 mt-10 -106.92 142.88 35.83 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.12 0.486 . . . . 0.0 111.56 -172.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.571 ' CD ' ' HA ' ' A' ' 92' ' ' ASP . 28.0 ttpp -66.74 137.12 56.43 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.207 -0.906 . . . . 0.0 111.702 -168.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.1 -6.28 36.82 Favored Glycine 0 N--CA 1.445 -0.733 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.586 -178.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.596 ' HB3' HD12 ' A' ' 90' ' ' LEU . 8.2 tt0 -91.65 116.41 28.85 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.53 0.681 . . . . 0.0 110.034 176.396 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.672 ' HG ' HD13 ' A' ' 26' ' ' LEU . 2.1 pt? -139.53 169.81 17.07 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.92 ' HB2' HD11 ' A' ' 26' ' ' LEU . 37.1 t 78.87 59.98 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 122.288 1.042 . . . . 0.0 109.877 -167.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -111.7 108.6 2.33 Favored Glycine 0 N--CA 1.439 -1.103 0 CA-C-N 114.192 -1.367 . . . . 0.0 109.79 168.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 37.4 t -92.11 113.6 27.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.0 0.429 . . . . 0.0 110.415 -173.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.563 HD11 ' HB2' ' A' ' 67' ' ' ALA . 71.3 mt -106.87 122.13 60.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.864 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.828 -179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 58.2 tttp -85.54 128.99 34.92 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.216 0.532 . . . . 0.0 110.794 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 16.2 m -118.66 161.51 19.96 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 174.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 26.2 t -69.58 -28.56 66.07 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.184 0.516 . . . . 0.0 109.707 176.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 10.7 p -84.33 -12.95 11.63 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.607 -177.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 157.94 -139.22 6.22 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.749 -0.738 . . . . 0.0 111.77 -177.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -131.16 149.38 52.61 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 117.048 0.424 . . . . 0.0 111.075 179.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.618 HD11 ' HB ' ' A' ' 10' ' ' ILE . 40.3 tp -121.41 135.46 55.06 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.15 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.643 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 28.9 mm -109.97 126.37 67.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 116.248 -0.433 . . . . 0.0 109.878 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.956 HG11 ' HB1' ' A' ' 67' ' ' ALA . 7.1 p -108.3 141.87 22.41 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 121.102 0.477 . . . . 0.0 110.497 -177.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.579 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 1.5 tmm_? -141.21 122.04 14.43 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.529 -175.326 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.686 ' HG ' HD13 ' A' ' 69' ' ' LEU . 9.8 mt -77.7 108.82 11.18 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-N 116.664 -0.244 . . . . 0.0 110.842 176.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.634 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 34.3 t70 -80.8 -54.17 5.84 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 119.32 -0.952 . . . . 0.0 111.54 175.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.571 ' HA ' ' CD ' ' A' ' 72' ' ' LYS . 2.7 t70 -156.47 170.69 21.74 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.71 -177.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.557 HG23 HG23 ' A' ' 6' ' ' THR . 0.4 OUTLIER -137.48 136.84 46.27 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.312 0 CA-C-O 121.086 0.47 . . . . 0.0 110.976 175.827 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.602 ' HB2' ' HG3' ' A' ' 5' ' ' ARG . 19.0 mt-30 -127.05 127.5 44.82 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.554 178.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.581 ' HA ' ' CE1' ' A' ' 99' ' ' HIS . . . 70.61 20.15 5.87 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.204 176.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.637 ' HB2' ' HB2' ' A' ' 4' ' ' GLN . . . -110.97 115.89 30.26 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.752 -176.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 74.87 -44.36 0.54 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.637 0.977 . . . . 0.0 113.637 166.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -59.32 -56.15 25.77 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -168.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.581 ' CE1' ' HA ' ' A' ' 95' ' ' ALA . 12.3 p-80 -98.38 -0.25 44.05 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.652 -178.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -163.32 122.01 2.03 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.317 -0.624 . . . . 0.0 109.317 176.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 8.4 p80 -60.23 124.29 19.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.568 0.699 . . . . 0.0 110.833 -175.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 . . . . . 0 C--N 1.316 -0.865 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.251 179.675 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 2.8 t . . . . . 0 N--CA 1.477 0.891 0 CA-C-O 121.348 0.594 . . . . 0.0 110.087 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -117.22 146.38 38.05 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.2 179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -86.07 126.15 2.78 Favored 'Trans proline' 0 N--CA 1.448 -1.182 0 C-N-CA 122.506 2.138 . . . . 0.0 110.841 175.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.467 ' HB2' ' HA ' ' A' ' 95' ' ' ALA . 30.0 pt20 -70.03 155.44 40.59 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 47.0 mtp180 -113.95 138.54 50.21 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 120.622 -0.431 . . . . 0.0 109.923 -175.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.699 HG23 HG13 ' A' ' 93' ' ' ILE . 10.8 m -120.75 137.77 54.34 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.335 -178.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.418 ' HB2' ' CE2' ' A' ' 54' ' ' TRP . 67.8 ttt180 -101.85 111.96 24.41 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.03 -0.532 . . . . 0.0 109.712 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.642 ' HD2' HD21 ' A' ' 55' ' ' LEU . 17.7 m-85 -107.03 133.45 51.66 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.673 -177.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.536 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 2.6 m -98.28 132.54 43.68 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 168.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.72 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.24 147.04 21.75 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.086 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 -177.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.757 HD11 HG11 ' A' ' 22' ' ' VAL . 3.3 pt -138.16 142.47 35.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 C-N-CA 120.423 -0.511 . . . . 0.0 109.71 177.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -97.49 115.52 27.97 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.094 0.473 . . . . 0.0 110.006 -177.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.43 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 77.3 p -99.01 148.93 23.5 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.398 -177.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -69.23 -34.23 74.52 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.77 -174.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -152.41 174.76 13.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.998 0.427 . . . . 0.0 111.923 -178.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -65.48 -26.46 67.94 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 175.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -59.56 -45.21 92.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 114.805 -1.089 . . . . 0.0 109.295 177.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.576 ' OE1' ' HG3' ' A' ' 39' ' ' LYS . 81.3 mm-40 -65.78 -44.86 84.49 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 114.669 -1.15 . . . . 0.0 110.635 176.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.599 ' HA ' HD11 ' A' ' 87' ' ' ILE . . . -56.41 -48.04 77.76 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.427 -176.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.468 ' HA ' ' HG ' ' A' ' 23' ' ' LEU . 1.5 mptm? -64.21 -33.54 76.04 Favored 'General case' 0 C--O 1.231 0.084 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 178.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.17 -41.5 70.27 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.085 0.469 . . . . 0.0 110.418 177.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.757 HG11 HD11 ' A' ' 11' ' ' ILE . 93.0 t -71.51 -49.17 48.63 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.368 -178.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.559 ' HA ' ' HG ' ' A' ' 26' ' ' LEU . 4.5 pp -63.01 -28.56 70.19 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.031 -176.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.47 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.1 t70 -65.88 -48.81 70.27 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.174 0.511 . . . . 0.0 109.952 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.464 ' HG2' HD21 ' A' ' 35' ' ' LEU . 6.6 tp10 -66.24 -43.98 85.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.679 -178.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.678 HD23 HG12 ' A' ' 22' ' ' VAL . 4.3 pp -73.43 -19.04 61.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.405 -0.362 . . . . 0.0 111.105 -178.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -75.0 -24.88 58.47 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 120.882 0.372 . . . . 0.0 110.45 176.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -71.92 -24.23 61.6 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 170.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.72 25.84 52.07 Favored Glycine 0 N--CA 1.443 -0.849 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.517 175.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -90.21 -63.6 1.25 Allowed Glycine 0 N--CA 1.442 -0.936 0 C-N-CA 119.154 -1.498 . . . . 0.0 113.061 -176.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -140.07 114.81 9.47 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 117.255 0.528 . . . . 0.0 111.604 177.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.556 ' CG ' ' HD3' ' A' ' 89' ' ' ARG . 60.2 t80 -86.78 -41.34 14.17 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.325 0.583 . . . . 0.0 109.874 170.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.664 ' O ' ' HG2' ' A' ' 37' ' ' LYS . . . -58.61 -35.44 72.46 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.013 -0.994 . . . . 0.0 111.221 -176.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -66.04 -38.42 88.34 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.49 0.662 . . . . 0.0 110.355 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.577 ' HB3' HG13 ' A' ' 22' ' ' VAL . 11.6 mt -65.32 -36.21 83.36 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.301 178.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.66 ' O ' ' HB3' ' A' ' 40' ' ' SER . . . -67.41 -41.24 85.2 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.612 -1.176 . . . . 0.0 111.126 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.664 ' HG2' ' O ' ' A' ' 33' ' ' ALA . 13.5 mmmm -69.62 -46.37 66.39 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.845 -0.616 . . . . 0.0 112.655 -173.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -80.02 -59.35 2.75 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 115.14 1.533 . . . . 0.0 115.14 -166.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.576 ' HG3' ' OE1' ' A' ' 18' ' ' GLU . 0.0 OUTLIER -100.27 -21.87 15.32 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 119.396 -0.922 . . . . 0.0 113.109 -174.692 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.66 ' HB3' ' O ' ' A' ' 36' ' ' ALA . 35.4 t -69.08 146.38 52.63 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-O 120.839 0.352 . . . . 0.0 111.515 -171.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.41 0.1 43.62 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.837 0.827 . . . . 0.0 109.931 174.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.598 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 38.6 t70 -66.54 -16.07 63.88 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.329 -1.305 . . . . 0.0 112.428 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.987 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.8 pp -55.16 -16.61 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 115.772 1.767 . . . . 0.0 115.772 -150.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 65.8 mt -61.97 -39.84 85.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 CA-C-N 118.421 0.555 . . . . 0.0 109.646 169.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.3 m -92.2 -30.88 15.69 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.322 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.987 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -52.63 -29.53 26.63 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.4 -0.818 . . . . 0.0 112.335 -176.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -53.58 -30.98 44.86 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.044 0.449 . . . . 0.0 110.941 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -90.99 9.9 28.78 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.225 179.27 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 90.28 24.71 28.28 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.812 -0.708 . . . . 0.0 111.586 -177.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.462 ' HA2' ' OD2' ' A' ' 42' ' ' ASP . . . 83.86 8.44 84.28 Favored Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.525 -0.63 . . . . 0.0 111.525 -176.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -72.34 108.74 5.62 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.214 0.531 . . . . 0.0 111.39 -178.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 54.2 mmm -82.48 -24.06 34.39 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.753 176.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 130.07 -160.36 22.9 Favored Glycine 0 N--CA 1.442 -0.905 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.036 -175.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.652 ' CH2' ' HG2' ' A' ' 94' ' ' GLN . 81.0 m95 -107.72 138.52 43.8 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.886 0.374 . . . . 0.0 110.993 -178.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.642 HD21 ' HD2' ' A' ' 8' ' ' TYR . 3.5 pp -126.24 156.18 40.68 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.208 176.053 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -82.2 130.51 35.11 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.077 0.465 . . . . 0.0 110.455 -179.427 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -70.29 147.05 50.14 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.165 178.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 71.65 7.24 5.91 Favored 'General case' 0 C--N 1.327 -0.38 0 O-C-N 124.34 1.025 . . . . 0.0 111.788 -176.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 25.1 p -111.7 2.1 17.04 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 166.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.596 ' HB ' ' HE3' ' A' ' 65' ' ' LYS . 45.6 mt -69.72 128.46 91.97 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 114.215 -1.357 . . . . 0.0 111.257 -173.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -65.98 157.01 61.57 Favored 'Trans proline' 0 C--O 1.237 0.465 0 C-N-CA 122.833 2.356 . . . . 0.0 111.445 174.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.525 ' HA ' ' HB2' ' A' ' 65' ' ' LYS . 7.4 p-10 -56.68 -21.37 27.19 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.601 -172.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.728 ' HG3' HG21 ' A' ' 79' ' ' ILE . 39.4 tt0 -56.29 -56.59 19.22 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.087 0.242 . . . . 0.0 110.614 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.406 ' HB2' ' CG2' ' A' ' 60' ' ' ILE . 4.8 mp -83.72 -16.62 44.2 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.722 -0.391 . . . . 0.0 111.504 -178.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.596 ' HE3' ' HB ' ' A' ' 60' ' ' ILE . 31.8 mmtp -60.13 -35.29 74.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.217 0.532 . . . . 0.0 110.435 174.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -78.3 -5.82 53.22 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.772 -178.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.79 -32.24 46.31 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.195 0.521 . . . . 0.0 110.419 177.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 68.98 22.09 75.67 Favored Glycine 0 C--N 1.335 0.474 0 CA-C-N 115.326 -0.852 . . . . 0.0 113.339 176.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.709 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 6.6 mt -86.81 88.49 7.69 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.004 0.43 . . . . 0.0 111.707 -174.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.421 ' HA ' ' HD2' ' A' ' 70' ' ' LYS . 23.1 tptp -100.58 -39.98 7.63 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 178.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -95.94 128.35 42.75 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.662 -0.245 . . . . 0.0 110.955 -174.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.635 ' HB2' HD13 ' A' ' 93' ' ' ILE . 82.6 tttt -66.58 134.73 52.95 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-O 121.151 0.501 . . . . 0.0 111.044 -172.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.13 -1.63 35.28 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.538 -177.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -92.16 130.77 37.8 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.166 0.507 . . . . 0.0 110.554 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.533 ' HB3' HD13 ' A' ' 26' ' ' LEU . 2.1 mp -118.82 169.77 9.57 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.691 -178.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.2 t 78.98 60.95 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 CA-C-O 121.797 0.808 . . . . 0.0 112.593 169.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -109.21 102.84 1.7 Allowed Glycine 0 N--CA 1.443 -0.849 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 163.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.406 HG21 HD23 ' A' ' 23' ' ' LEU . 19.9 t -100.46 113.88 37.54 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.482 0 CA-C-O 121.004 0.43 . . . . 0.0 110.007 -177.317 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.728 HG21 ' HG3' ' A' ' 63' ' ' GLU . 51.5 mm -109.62 127.01 66.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.7 -177.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -77.6 125.31 29.14 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.379 177.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 14.0 m -119.9 163.79 17.02 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.029 178.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.2 m -68.91 -26.4 65.07 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.25 0.548 . . . . 0.0 110.262 177.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 14.7 p -84.1 -12.54 11.72 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.238 -178.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 150.7 -133.06 4.14 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 121.007 -0.616 . . . . 0.0 111.786 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -130.1 139.41 50.94 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 120.658 0.265 . . . . 0.0 110.511 178.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.72 HD11 ' HB ' ' A' ' 10' ' ' ILE . 29.9 tp -120.48 135.67 54.99 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.816 -0.439 . . . . 0.0 109.816 -178.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.599 HD11 ' HA ' ' A' ' 19' ' ' ALA . 5.0 mt -119.23 125.88 74.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.541 HG23 HD12 ' A' ' 69' ' ' LEU . 1.8 m -113.16 145.9 18.5 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-O 121.486 0.66 . . . . 0.0 111.311 -174.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.556 ' HD3' ' CG ' ' A' ' 32' ' ' PHE . 34.3 ttp180 -134.58 145.86 49.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.196 -178.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.864 HD22 HD11 ' A' ' 93' ' ' ILE . 14.6 mt -87.42 108.29 18.94 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.079 0.466 . . . . 0.0 111.284 179.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.482 ' O ' ' HE3' ' A' ' 72' ' ' LYS . 3.7 t0 -80.92 -53.76 6.17 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.897 178.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.409 ' C ' HD12 ' A' ' 93' ' ' ILE . 10.8 m-20 -154.51 160.36 41.51 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.113 -177.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.864 HD11 HD22 ' A' ' 90' ' ' LEU . 3.4 mp -136.05 127.69 44.39 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.302 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 172.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.652 ' HG2' ' CH2' ' A' ' 54' ' ' TRP . 81.6 mm-40 -128.23 120.02 26.37 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.768 0.318 . . . . 0.0 110.36 177.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.467 ' HA ' ' HB2' ' A' ' 4' ' ' GLN . . . -86.9 51.87 2.36 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.033 -179.311 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 56.08 85.06 0.08 Allowed 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.188 -178.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 81.4 m-70 69.21 -142.98 0.09 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.657 -174.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 4.6 t-160 74.49 -47.17 0.63 Allowed 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.974 0.909 . . . . 0.0 110.862 179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 82.3 t60 -97.86 131.41 44.37 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 170.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 25.1 t-80 -76.58 71.95 3.22 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.991 0.424 . . . . 0.0 111.89 -171.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -161.12 24.28 0.13 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 172.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.095 -0.955 . . . . 0.0 109.83 -178.332 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 56.0 p . . . . . 0 N--CA 1.477 0.907 0 CA-C-O 120.68 0.276 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLN . . . . . 0.431 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 79.8 mt-30 -72.92 124.37 90.64 Favored Pre-proline 0 N--CA 1.451 -0.399 0 CA-C-O 121.469 0.652 . . . . 0.0 111.443 -178.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 2' ' ' GLN . 92.3 Cg_endo -91.66 109.61 0.29 Allowed 'Trans proline' 0 N--CA 1.447 -1.258 0 C-N-CA 123.557 2.838 . . . . 0.0 111.73 177.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.652 ' HB2' ' HB2' ' A' ' 96' ' ' ALA . 15.6 pt20 -70.81 158.12 36.9 Favored 'General case' 0 N--CA 1.448 -0.565 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 176.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -121.99 135.0 54.81 Favored 'General case' 0 C--N 1.312 -1.034 0 C-N-CA 120.033 -0.667 . . . . 0.0 110.389 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.731 HG23 HG13 ' A' ' 93' ' ' ILE . 22.3 m -128.67 133.59 48.26 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.311 -177.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.633 ' HD3' ' OD2' ' A' ' 91' ' ' ASP . 34.1 ttt180 -95.44 111.47 23.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 179.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.646 ' HD2' HD21 ' A' ' 55' ' ' LEU . 14.7 m-85 -103.96 135.4 45.55 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.283 -178.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.669 ' HB2' ' HB3' ' A' ' 89' ' ' ARG . 0.7 OUTLIER -96.33 132.18 42.09 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 168.588 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.87 ' HB ' HD11 ' A' ' 86' ' ' LEU . 2.8 pp -142.7 141.38 27.48 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 -178.225 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.628 HG12 ' HB ' ' A' ' 87' ' ' ILE . 5.6 pt -140.49 149.15 21.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 177.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -103.27 113.32 26.72 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.496 -174.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.81 ' HB ' ' HB2' ' A' ' 18' ' ' GLU . 16.1 p -94.66 141.83 28.16 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.261 178.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -64.55 -30.78 71.81 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.782 -174.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -151.31 173.67 14.21 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.511 ' HG2' ' HE2' ' A' ' 20' ' ' LYS . 32.2 tt0 -64.13 -36.58 84.5 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -53.05 -39.54 63.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.979 177.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.81 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 6.1 mm-40 -67.38 -37.1 82.61 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.776 -179.347 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -63.83 -39.52 94.42 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.088 179.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.511 ' HE2' ' HG2' ' A' ' 16' ' ' GLU . 5.1 mptp? -55.55 -48.41 74.78 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.098 176.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.13 -31.05 72.1 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.961 0.41 . . . . 0.0 111.126 -178.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.513 HG11 HD11 ' A' ' 11' ' ' ILE . 94.4 t -75.68 -51.91 19.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.074 179.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.459 HD12 ' N ' ' A' ' 24' ' ' ASP . 4.6 pp -66.64 -27.78 67.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.252 -176.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.459 ' N ' HD12 ' A' ' 23' ' ' LEU . 28.1 t70 -64.26 -46.72 82.49 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.759 0.314 . . . . 0.0 111.209 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.456 ' HB3' HD21 ' A' ' 35' ' ' LEU . 29.9 tt0 -75.35 -40.15 58.5 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.29 -176.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 75' ' ' LEU . 2.8 pp -69.96 -13.66 62.34 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.395 -0.522 . . . . 0.0 110.661 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.452 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.5 OUTLIER -69.5 -21.03 63.71 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.95 174.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -88.99 -26.19 21.62 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 169.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 81.74 33.93 26.17 Favored Glycine 0 N--CA 1.449 -0.496 0 CA-C-N 114.609 -1.178 . . . . 0.0 113.397 170.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.67 -63.41 1.48 Allowed Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 119.025 -1.559 . . . . 0.0 112.839 -176.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.521 ' O ' ' HG ' ' A' ' 35' ' ' LEU . 3.0 m-20 -139.48 116.65 11.12 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.883 0.342 . . . . 0.0 111.613 177.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.526 ' HA ' HD12 ' A' ' 35' ' ' LEU . 43.3 t80 -81.71 -37.87 26.66 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 108.674 -0.861 . . . . 0.0 108.674 169.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -54.49 -37.72 65.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 114.916 -1.038 . . . . 0.0 110.834 176.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.72 -39.13 84.33 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.581 -178.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.526 HD12 ' HA ' ' A' ' 32' ' ' PHE . 11.4 mt -66.99 -43.04 83.99 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.276 -0.874 . . . . 0.0 109.196 177.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.428 ' CB ' HG21 ' A' ' 11' ' ' ILE . . . -59.28 -53.29 59.92 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.394 -1.276 . . . . 0.0 111.892 -177.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.497 ' HA ' HG22 ' A' ' 43' ' ' ILE . 40.2 mtpt -75.66 -29.5 59.1 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.906 -169.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -79.92 -56.03 4.55 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -178.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.813 ' O ' ' HD3' ' A' ' 39' ' ' LYS . 1.2 tppp? -97.66 -24.74 15.37 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -163.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.625 ' CB ' ' HB ' ' A' ' 11' ' ' ILE . 24.7 p -92.17 156.56 17.25 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.024 -1.048 . . . . 0.0 112.387 -165.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.98 6.07 19.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.335 172.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.466 ' HB2' ' HA ' ' A' ' 11' ' ' ILE . 13.1 t70 -75.27 -15.24 60.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.051 -0.977 . . . . 0.0 112.218 -177.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 1.033 ' HA ' ' HB3' ' A' ' 46' ' ' ALA . 2.7 pp -55.8 -15.98 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -152.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.477 ' N ' HD12 ' A' ' 43' ' ' ILE . 58.3 mt -53.93 -37.56 34.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 118.427 0.558 . . . . 0.0 109.748 169.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 p -107.72 -25.09 11.45 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.483 175.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 1.033 ' HB3' ' HA ' ' A' ' 43' ' ' ILE . . . -56.65 -29.21 62.01 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 178.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.521 ' HG3' ' O ' ' A' ' 43' ' ' ILE . 99.2 mtt180 -57.87 -15.84 9.88 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.866 0.365 . . . . 0.0 111.524 176.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.452 HD22 ' HB2' ' A' ' 51' ' ' ASP . 11.6 t30 -89.65 10.73 22.08 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.654 0.74 . . . . 0.0 109.866 176.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 91.54 10.19 62.17 Favored Glycine 0 N--CA 1.453 -0.187 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.074 -177.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.431 ' HA2' ' HA ' ' A' ' 46' ' ' ALA . . . 96.57 -13.5 65.36 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.109 177.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.539 ' HA ' ' HA ' ' A' ' 9' ' ' SER . 47.6 m-20 -72.95 114.4 11.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 110.398 -0.223 . . . . 0.0 110.398 -179.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.504 ' HG2' ' O ' ' A' ' 8' ' ' TYR . 27.0 ptm -71.93 -21.81 61.56 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.899 -177.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 132.23 -159.62 23.4 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.83 -0.7 . . . . 0.0 111.86 -179.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.432 ' CH2' ' HG3' ' A' ' 94' ' ' GLN . 86.1 m95 -109.04 117.02 33.1 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 120.82 0.343 . . . . 0.0 110.633 -179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.646 HD21 ' HD2' ' A' ' 8' ' ' TYR . 2.0 pp -103.66 151.81 22.53 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.109 -0.496 . . . . 0.0 109.79 174.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -92.39 136.77 32.92 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.65 -0.704 . . . . 0.0 109.103 177.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -57.04 147.99 22.8 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.144 177.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . 70.73 6.99 6.06 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.263 -0.881 . . . . 0.0 112.383 -178.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 30.2 p -111.81 7.45 20.18 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 163.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.646 ' HB ' ' HE3' ' A' ' 65' ' ' LYS . 36.1 mt -86.24 127.25 62.17 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 114.185 -1.37 . . . . 0.0 110.633 -174.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -65.91 151.74 83.31 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 122.445 2.096 . . . . 0.0 111.396 174.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.412 ' HA ' ' CG ' ' A' ' 65' ' ' LYS . 5.2 p-10 -59.34 -17.88 33.42 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.349 -176.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -64.04 -47.28 80.81 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.778 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 5.8 mp -83.4 -15.06 51.26 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.825 0.345 . . . . 0.0 110.659 177.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.646 ' HE3' ' HB ' ' A' ' 60' ' ' ILE . 33.2 mmtp -63.34 -30.51 71.63 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.487 0.66 . . . . 0.0 109.764 173.37 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -74.0 -11.52 60.36 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.263 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.551 ' HB1' HG11 ' A' ' 88' ' ' VAL . . . -70.49 -31.35 68.42 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.1 0.476 . . . . 0.0 111.151 -178.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 64.47 19.3 64.43 Favored Glycine 0 C--N 1.334 0.458 0 CA-C-N 115.327 -0.851 . . . . 0.0 112.751 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.713 ' HB3' ' HG ' ' A' ' 90' ' ' LEU . 18.6 mt -85.34 90.9 8.04 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.048 0.451 . . . . 0.0 111.142 -176.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 17.0 tptm -100.41 -43.49 6.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.66 -178.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -107.64 135.31 49.3 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.764 0.316 . . . . 0.0 110.905 -174.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.605 ' HD3' ' HA ' ' A' ' 92' ' ' ASP . 6.7 ttpm? -66.58 138.97 57.86 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.767 -171.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 107.39 -5.19 35.42 Favored Glycine 0 N--CA 1.448 -0.549 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -94.19 128.49 40.66 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 121.231 0.538 . . . . 0.0 110.035 177.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.753 HD13 HD13 ' A' ' 26' ' ' LEU . 1.2 pp -145.14 170.91 15.31 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.902 -175.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.62 ' HB2' ' CD1' ' A' ' 26' ' ' LEU . 25.6 t 79.25 49.71 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.405 0 O-C-N 124.425 1.078 . . . . 0.0 110.809 -174.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.421 ' O ' HG12 ' A' ' 88' ' ' VAL . . . -98.72 110.73 4.07 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 168.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.29 113.36 39.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -176.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.562 ' HB ' ' HB3' ' A' ' 86' ' ' LEU . 47.5 mm -97.0 114.84 34.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.478 -175.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.773 ' HG2' ' CE2' ' A' ' 85' ' ' PHE . 2.4 tmtp? -83.62 113.92 21.18 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.456 -0.793 . . . . 0.0 110.166 -174.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 17.7 m -122.93 167.41 13.61 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.134 176.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 9.5 t -84.59 -26.32 28.02 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 176.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 32.9 m -77.78 -10.45 13.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.241 177.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 149.24 -159.38 28.03 Favored Glycine 0 N--CA 1.445 -0.75 0 N-CA-C 111.416 -0.674 . . . . 0.0 111.416 -179.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' PHE . . . . . 0.773 ' CE2' ' HG2' ' A' ' 80' ' ' LYS . 91.1 m-85 -125.66 132.5 52.42 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.848 0.356 . . . . 0.0 110.513 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.87 HD11 ' HB ' ' A' ' 10' ' ' ILE . 41.6 tp -107.19 135.37 48.84 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.147 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.663 ' O ' ' HA ' ' A' ' 10' ' ' ILE . 22.4 mm -108.1 124.14 64.14 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.581 HG22 HD12 ' A' ' 69' ' ' LEU . 12.1 p -113.51 139.5 38.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.811 0 CA-C-O 121.355 0.597 . . . . 0.0 111.232 -175.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.669 ' HB3' ' HB2' ' A' ' 9' ' ' SER . 7.5 ttp180 -136.49 148.0 47.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.815 179.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.713 ' HG ' ' HB3' ' A' ' 69' ' ' LEU . 11.9 mt -94.72 109.42 21.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.619 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.633 ' OD2' ' HD3' ' A' ' 7' ' ' ARG . 37.1 t70 -80.46 -55.05 5.15 Favored 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 119.942 -0.703 . . . . 0.0 111.58 175.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.605 ' HA ' ' HD3' ' A' ' 72' ' ' LYS . 35.9 t70 -157.13 160.21 38.59 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.62 0.248 . . . . 0.0 111.232 177.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.731 HG13 HG23 ' A' ' 6' ' ' THR . 3.8 mp -124.73 127.1 72.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.268 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 172.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.432 ' HG3' ' CH2' ' A' ' 54' ' ' TRP . 20.9 mt-30 -115.94 156.36 26.36 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.987 0.366 . . . . 0.0 111.987 -176.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . 72.83 -53.29 0.7 Allowed 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.025 -0.988 . . . . 0.0 112.551 176.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.652 ' HB2' ' HB2' ' A' ' 4' ' ' GLN . . . -57.34 -49.28 76.65 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 115.796 -0.638 . . . . 0.0 112.158 -174.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' HIS . . . . . 0.401 ' HA ' ' H ' ' A' ' 102' ' ' HIS . 33.5 t-80 -80.51 -20.27 43.96 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.009 -172.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' HIS . . . . . . . . . . . . . 11.6 t-160 -93.7 -27.21 16.66 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.527 -175.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 2.7 m-70 -65.94 -69.5 0.3 Allowed 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 121.025 -0.27 . . . . 0.0 111.662 -179.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . . . . . . . . . 12.4 m170 -135.84 39.24 2.79 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.986 -0.285 . . . . 0.0 111.447 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' HIS . . . . . . . . . . . . . 47.7 m170 54.4 75.85 0.27 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.475 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.401 ' H ' ' HA ' ' A' ' 97' ' ' HIS . 11.2 m-70 . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.301 -0.857 . . . . 0.0 109.713 170.947 . . . . . . . . 1 1 . 1 stop_ save_